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

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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