ethyl 2,5-dimethyl-1-[[4-(phenylcarbamoyl)cyclohexyl]methyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[[4-(phenylcarbamoyl)cyclohexyl]methyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[[4-(phenylcarbamoyl)cyclohexyl]methyl]pyrrole-3-carboxylate CAS Name: 1-[[4-[anilino(oxo)methyl]cyclohexyl]methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[[4-(phenylcarbamoyl)cyclohexyl]methyl]pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-[[4-(phenylcarbamoyl)cyclohexyl]methyl]pyrrole-3-carboxylic acid ethyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC2CCC(CC2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC2CCC(CC2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N2O3/c1-4-28-23(27)21-14-16(2)25(17(21)3)15-18-10-12-19(13-11-18)22(26)24-20-8-6-5-7-9-20/h5-9,14,18-19H,4,10-13,15H2,1-3H3,(H,24,26)