methyl 1-[3-(2,4-dimethylphenyl)propanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[3-(2,4-dimethylphenyl)propanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[3-(2,4-dimethylphenyl)propanoylamino]cyclohexanecarboxylate CAS Name: 1-[[3-(2,4-dimethylphenyl)-1-oxopropyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(2,4-dimethylphenyl)propanoylamino]cyclohexane-1-carboxylate Traditional Name: 1-[3-(2,4-dimethylphenyl)propanoylamino]cyclohexanecarboxylic acid methyl ester Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)NC2(CCCCC2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)NC2(CCCCC2)C(=O)OC)C

InChI

InChI=1S/C19H27NO3/c1-14-7-8-16(15(2)13-14)9-10-17(21)20-19(18(22)23-3)11-5-4-6-12-19/h7-8,13H,4-6,9-12H2,1-3H3,(H,20,21)