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

Systemtic Name: ethyl 2,4-dimethyl-5-[4-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[4-[1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-[1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]-1-piperidinyl]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[4-[1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-[2-keto-1-methyl-2-(4-phenylpiperazino)ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)C(C)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)C(C)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H38N4O4/c1-5-36-28(35)24-20(3)25(29-21(24)4)27(34)31-13-11-22(12-14-31)19(2)26(33)32-17-15-30(16-18-32)23-9-7-6-8-10-23/h6-10,19,22,29H,5,11-18H2,1-4H3