methyl 5-(4-benzamidopiperidin-1-yl)carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(4-benzamidopiperidin-1-yl)carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(4-benzamidopiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(4-benzamido-1-piperidinyl)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-benzamidopiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-benzamidopiperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-13-17(21(27)28-3)14(2)22-18(13)20(26)24-11-9-16(10-12-24)23-19(25)15-7-5-4-6-8-15/h4-8,16,22H,9-12H2,1-3H3,(H,23,25)