6-[(4-butylphenyl)carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(4-butylphenyl)carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(4-butylphenyl)carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(4-butylanilino)-oxomethyl]-3-methyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(4-butylphenyl)carbamoyl]-3-methylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(4-butylphenyl)carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CC=C(CC2C(=O)O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2CC=C(CC2C(=O)O)C

InChI

InChI=1S/C19H25NO3/c1-3-4-5-14-7-9-15(10-8-14)20-18(21)16-11-6-13(2)12-17(16)19(22)23/h6-10,16-17H,3-5,11-12H2,1-2H3,(H,20,21)(H,22,23)