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

Systemtic Name: ethyl 5-[4-[1-[(4-ethoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[4-[2-[(4-ethoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[4-[1-[(4-ethoxyphenyl)methylamino]-1-oxopropan-2-yl]-1-piperidinyl]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[1-[(4-ethoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-[2-[(4-ethoxybenzyl)amino]-2-keto-1-methyl-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C27H37N3O5 MolecularWeight: 483.59978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C(C)C2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C(C)C2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C27H37N3O5/c1-6-34-22-10-8-20(9-11-22)16-28-25(31)17(3)21-12-14-30(15-13-21)26(32)24-18(4)23(19(5)29-24)27(33)35-7-2/h8-11,17,21,29H,6-7,12-16H2,1-5H3,(H,28,31)