ethyl 5-[[cyclohexylcarbonyl-(phenylmethyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[[cyclohexylcarbonyl-(phenylmethyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[[benzyl(cyclohexanecarbonyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[cyclohexyl(oxo)methyl]-(phenylmethyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[benzyl(cyclohexanecarbonyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[benzyl(cyclohexanecarbonyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)CN(CC2=CC=CC=C2)C(=O)C3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)CN(CC2=CC=CC=C2)C(=O)C3CCCCC3)C

InChI

InChI=1S/C24H32N2O3/c1-4-29-24(28)22-17(2)21(25-18(22)3)16-26(15-19-11-7-5-8-12-19)23(27)20-13-9-6-10-14-20/h5,7-8,11-12,20,25H,4,6,9-10,13-16H2,1-3H3