ethyl 4-(4-bromophenyl)-1-[2-(1-methyl-5-oxidanylidene-4,4-diphenyl-pyrrolidin-3-yl)ethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-1-[2-(1-methyl-5-oxidanylidene-4,4-diphenyl-pyrrolidin-3-yl)ethyl]piperidine-4-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-1-[2-(1-methyl-5-oxo-4,4-diphenyl-pyrrolidin-3-yl)ethyl]piperidine-4-carboxylate CAS Name: 4-(4-bromophenyl)-1-[2-(1-methyl-5-oxo-4,4-diphenyl-3-pyrrolidinyl)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-1-[2-(1-methyl-5-oxo-4,4-diphenylpyrrolidin-3-yl)ethyl]piperidine-4-carboxylate Traditional Name: 4-(4-bromophenyl)-1-[2-(5-keto-1-methyl-4,4-diphenyl-pyrrolidin-3-yl)ethyl]isonipecotic acid ethyl ester Formula: C33H37BrN2O3 MolecularWeight: 589.56248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCC2CN(C(=O)C2(C3=CC=CC=C3)C4=CC=CC=C4)C)C5=CC=C(C=C5)Br

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCC2CN(C(=O)C2(C3=CC=CC=C3)C4=CC=CC=C4)C)C5=CC=C(C=C5)Br

InChI

InChI=1S/C33H37BrN2O3/c1-3-39-31(38)32(25-14-16-29(34)17-15-25)19-22-36(23-20-32)21-18-28-24-35(2)30(37)33(28,26-10-6-4-7-11-26)27-12-8-5-9-13-27/h4-17,28H,3,18-24H2,1-2H3