(3S)-1-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[[2-(3,4-dimethoxyphenyl)-4-quinolinyl]-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]-N-phenyl-nipecotamide Formula: C30H29N3O4 MolecularWeight: 495.56896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCCC(C4)C(=O)NC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCC[C@@H](C4)C(=O)NC5=CC=CC=C5)OC

InChI

InChI=1S/C30H29N3O4/c1-36-27-15-14-20(17-28(27)37-2)26-18-24(23-12-6-7-13-25(23)32-26)30(35)33-16-8-9-21(19-33)29(34)31-22-10-4-3-5-11-22/h3-7,10-15,17-18,21H,8-9,16,19H2,1-2H3,(H,31,34)/t21-/m0/s1