(3S)-N3-(4-bromanyl-2-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-(4-bromanyl-2-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-(4-bromo-2-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-(4-bromo-2-methylphenyl)-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-(4-bromo-2-methylphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-(4-bromo-2-methyl-phenyl)-N-phenyl-piperidine-1,3-dicarboxamide Formula: C20H22BrN3O2 MolecularWeight: 416.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22BrN3O2/c1-14-12-16(21)9-10-18(14)23-19(25)15-6-5-11-24(13-15)20(26)22-17-7-3-2-4-8-17/h2-4,7-10,12,15H,5-6,11,13H2,1H3,(H,22,26)(H,23,25)/t15-/m0/s1