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1-(acetamidomethyl)-4-(2-methylphenyl)cyclohexa-2,5-diene-1-carboxylic acid

1-(acetamidomethyl)-4-(2-methylphenyl)cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name:1-(acetamidomethyl)-4-(2-methylphenyl)cyclohexa-2,5-diene-1-carboxylic acid
Openeye Name:1-(acetamidomethyl)-4-(o-tolyl)cyclohexa-2,5-diene-1-carboxylic acid
CAS Name:1-(acetamidomethyl)-4-(2-methylphenyl)-1-cyclohexa-2,5-dienecarboxylic acid
IUPAC Name:1-(acetamidomethyl)-4-(2-methylphenyl)cyclohexa-2,5-diene-1-carboxylic acid
Traditional Name:1-(acetamidomethyl)-4-(o-tolyl)cyclohexa-2,5-diene-1-carboxylic acid
Formula: C17H19NO3
MolecularWeight: 285.33766
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C=CC(C=C2)(CNC(=O)C)C(=O)O


Isomeric SMILES

CC1=CC=CC=C1C2C=CC(C=C2)(CNC(=O)C)C(=O)O


InChI

InChI=1S/C17H19NO3/c1-12-5-3-4-6-15(12)14-7-9-17(10-8-14,16(20)21)11-18-13(2)19/h3-10,14H,11H2,1-2H3,(H,18,19)(H,20,21)


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