(phenylmethyl) 4-[2-[cyclohexylcarbamoyl(phenyl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[cyclohexylcarbamoyl(phenyl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-[2-[N-(cyclohexylcarbamoyl)anilino]-2-oxo-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-(N-[(cyclohexylamino)-oxomethyl]anilino)-2-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[N-(cyclohexylcarbamoyl)anilino]-2-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[N-(cyclohexylcarbamoyl)anilino]-2-keto-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CC(=O)N(C2=CC=CC=C2)C(=O)NC3CCCCC3)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=C1CC(=O)N(C2=CC=CC=C2)C(=O)NC3CCCCC3)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H33N3O4/c1-20-25(21(2)30-27(20)28(34)36-19-22-12-6-3-7-13-22)18-26(33)32(24-16-10-5-11-17-24)29(35)31-23-14-8-4-9-15-23/h3,5-7,10-13,16-17,23,30H,4,8-9,14-15,18-19H2,1-2H3,(H,31,35)