6-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-(homoveratrylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CC=CCC2C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2CC=CCC2C(=O)O)OC

InChI

InChI=1S/C18H23NO5/c1-23-15-8-7-12(11-16(15)24-2)9-10-19-17(20)13-5-3-4-6-14(13)18(21)22/h3-4,7-8,11,13-14H,5-6,9-10H2,1-2H3,(H,19,20)(H,21,22)