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

Systemtic Name: methyl 2,4-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3/c1-14-18(21(25)26-3)15(2)22-19(14)20(24)23-11-9-17(10-12-23)13-16-7-5-4-6-8-16/h4-8,17,22H,9-13H2,1-3H3