(2-bromophenyl)methyl 1-ethanoyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: (2-bromophenyl)methyl 1-ethanoyl-4-phenyl-piperidine-4-carboxylate Openeye Name: (2-bromophenyl)methyl 1-acetyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-acetyl-4-phenyl-4-piperidinecarboxylic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl 1-acetyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-acetyl-4-phenyl-isonipecotic acid (2-bromobenzyl) ester Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3Br

Isomeric SMILES

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3Br

InChI

InChI=1S/C21H22BrNO3/c1-16(24)23-13-11-21(12-14-23,18-8-3-2-4-9-18)20(25)26-15-17-7-5-6-10-19(17)22/h2-10H,11-15H2,1H3