ethyl 2,4-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-benzylpiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-benzylpiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-benzylpiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O3/c1-4-27-22(26)19-15(2)20(23-16(19)3)21(25)24-12-10-18(11-13-24)14-17-8-6-5-7-9-17/h5-9,18,23H,4,10-14H2,1-3H3