methyl 1-(4-bromophenyl)carbonyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-(4-bromophenyl)carbonyl-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-(4-bromobenzoyl)-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(4-bromophenyl)-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromobenzoyl)-4-phenylpiperidine-4-carboxylate Traditional Name: 1-(4-bromobenzoyl)-4-phenyl-isonipecotic acid methyl ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H20BrNO3/c1-25-19(24)20(16-5-3-2-4-6-16)11-13-22(14-12-20)18(23)15-7-9-17(21)10-8-15/h2-10H,11-14H2,1H3