N-[1-[4-(3,4-dichlorophenyl)carbonylpiperidin-1-yl]-3-methyl-butan-2-yl]quinoline-3-carboxamide

Systemtic Name: N-[1-[4-(3,4-dichlorophenyl)carbonylpiperidin-1-yl]-3-methyl-butan-2-yl]quinoline-3-carboxamide Openeye Name: N-[1-[[4-(3,4-dichlorobenzoyl)-1-piperidyl]methyl]-2-methyl-propyl]quinoline-3-carboxamide CAS Name: N-[1-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperidinyl]-3-methylbutan-2-yl]-3-quinolinecarboxamide IUPAC Name: N-[1-[4-(3,4-dichlorobenzoyl)piperidin-1-yl]-3-methylbutan-2-yl]quinoline-3-carboxamide Traditional Name: N-[1-[[4-(3,4-dichlorobenzoyl)piperidino]methyl]-2-methyl-propyl]quinoline-3-carboxamide Formula: C27H29Cl2N3O2 MolecularWeight: 498.44406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1CCC(CC1)C(=O)C2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)C(CN1CCC(CC1)C(=O)C2=CC(=C(C=C2)Cl)Cl)NC(=O)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C27H29Cl2N3O2/c1-17(2)25(31-27(34)21-13-19-5-3-4-6-24(19)30-15-21)16-32-11-9-18(10-12-32)26(33)20-7-8-22(28)23(29)14-20/h3-8,13-15,17-18,25H,9-12,16H2,1-2H3,(H,31,34)