(Q82927995)

English

5-Phenyloctahydro-1H-4,7-methanoinden-5-yl 4-nitrobenzoate

chemical compound

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No description defined

Statements

type of chemical entity

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chemical compound

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377.162708216 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₃NO₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

O=C(OC1(c2ccccc2)CC2CC1C1CCCC21)c1ccc([N+](=O)[O-])cc1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C23H23NO4/c25-22(15-9-11-18(12-10-15)24(26)27)28-23(17-5-2-1-3-6-17)14-16-13-21(23)20-8-4-7-19(16)20/h1-3,5-6,9-12,16,19-21H,4,7-8,13-14H2

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NKRYLCNOHSETBE-UHFFFAOYSA-N

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CAS Registry Number

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1 reference

matched by identifier from

NKRYLCNOHSETBE-UHFFFAOYSA-N

DSSTox substance ID

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matched by identifier from

NKRYLCNOHSETBE-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID301378192

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