(3S)-N3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-(4-chloro-2-methoxy-5-methyl-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-(4-chloro-2-methoxy-5-methylphenyl)-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-(4-chloro-2-methoxy-5-methylphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-(4-chloro-2-methoxy-5-methyl-phenyl)-N-phenyl-piperidine-1,3-dicarboxamide Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O3/c1-14-11-18(19(28-2)12-17(14)22)24-20(26)15-7-6-10-25(13-15)21(27)23-16-8-4-3-5-9-16/h3-5,8-9,11-12,15H,6-7,10,13H2,1-2H3,(H,23,27)(H,24,26)/t15-/m0/s1