4-methyl-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid

Systemtic Name: 4-methyl-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid Openeye Name: 4-methyl-2-[3-(2-naphthyl)propanoylamino]cyclohexene-1-carboxylic acid CAS Name: 4-methyl-2-[[3-(2-naphthalenyl)-1-oxopropyl]amino]-1-cyclohexenecarboxylic acid IUPAC Name: 4-methyl-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid Traditional Name: 4-methyl-2-[3-(2-naphthyl)propanoylamino]cyclohexene-1-carboxylic acid Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=C(C1)NC(=O)CCC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

CC1CCC(=C(C1)NC(=O)CCC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C21H23NO3/c1-14-6-10-18(21(24)25)19(12-14)22-20(23)11-8-15-7-9-16-4-2-3-5-17(16)13-15/h2-5,7,9,13-14H,6,8,10-12H2,1H3,(H,22,23)(H,24,25)