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

Systemtic Name: (3S)-N3-(5-chloranyl-2,4-dimethoxy-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-(5-chloro-2,4-dimethoxy-phenyl)-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-(5-chloro-2,4-dimethoxyphenyl)-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-(5-chloro-2,4-dimethoxyphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-(5-chloro-2,4-dimethoxy-phenyl)-N-phenyl-piperidine-1,3-dicarboxamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C21H24ClN3O4/c1-28-18-12-19(29-2)17(11-16(18)22)24-20(26)14-7-6-10-25(13-14)21(27)23-15-8-4-3-5-9-15/h3-5,8-9,11-12,14H,6-7,10,13H2,1-2H3,(H,23,27)(H,24,26)/t14-/m0/s1