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

Systemtic Name: ethyl 2,4-dimethyl-5-[4-[1-oxidanylidene-1-[(4-propan-2-yloxyphenyl)methylamino]propan-2-yl]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[4-[2-[(4-isopropoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-[1-oxo-1-[(4-propan-2-yloxyphenyl)methylamino]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-propan-2-yloxyphenyl)methylamino]propan-2-yl]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-[2-[(4-isopropoxybenzyl)amino]-2-keto-1-methyl-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C28H39N3O5 MolecularWeight: 497.62636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)C(C)C(=O)NCC3=CC=C(C=C3)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC(CC2)C(C)C(=O)NCC3=CC=C(C=C3)OC(C)C)C

InChI

InChI=1S/C28H39N3O5/c1-7-35-28(34)24-19(5)25(30-20(24)6)27(33)31-14-12-22(13-15-31)18(4)26(32)29-16-21-8-10-23(11-9-21)36-17(2)3/h8-11,17-18,22,30H,7,12-16H2,1-6H3,(H,29,32)