N-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-phenyl-quinolin-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-phenyl-quinolin-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-phenyl-quinoline-4-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(6-methyl-2-phenyl-4-quinolinyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-phenylquinoline-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-phenyl-quinoline-4-carbonyl)isonipecotamide Formula: C30H27N3O4 MolecularWeight: 493.55308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

InChI

InChI=1S/C30H27N3O4/c1-19-7-9-25-23(15-19)24(17-26(32-25)20-5-3-2-4-6-20)30(35)33-13-11-21(12-14-33)29(34)31-22-8-10-27-28(16-22)37-18-36-27/h2-10,15-17,21H,11-14,18H2,1H3,(H,31,34)