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

Systemtic Name: ethyl 5-[4-[1-[(4-dimethylaminophenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[4-[2-[(4-dimethylaminophenyl)methylamino]-1-methyl-2-oxo-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[4-[1-[(4-dimethylaminophenyl)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-dimethylaminophenyl)methylamino]-1-oxopropan-2-yl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-[2-[[4-(dimethylamino)benzyl]amino]-2-keto-1-methyl-ethyl]piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C27H38N4O4 MolecularWeight: 482.61502

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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)N(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H38N4O4/c1-7-35-27(34)23-18(3)24(29-19(23)4)26(33)31-14-12-21(13-15-31)17(2)25(32)28-16-20-8-10-22(11-9-20)30(5)6/h8-11,17,21,29H,7,12-16H2,1-6H3,(H,28,32)