N-[[1-[1-(3,4-dichlorophenyl)carbonylpiperidin-4-yl]piperidin-3-yl]methyl]quinoline-6-carboxamide

Systemtic Name: N-[[1-[1-(3,4-dichlorophenyl)carbonylpiperidin-4-yl]piperidin-3-yl]methyl]quinoline-6-carboxamide Openeye Name: N-[[1-[1-(3,4-dichlorobenzoyl)-4-piperidyl]-3-piperidyl]methyl]quinoline-6-carboxamide CAS Name: N-[[1-[1-[(3,4-dichlorophenyl)-oxomethyl]-4-piperidinyl]-3-piperidinyl]methyl]-6-quinolinecarboxamide IUPAC Name: N-[[1-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]piperidin-3-yl]methyl]quinoline-6-carboxamide Traditional Name: N-[[1-[1-(3,4-dichlorobenzoyl)-4-piperidyl]-3-piperidyl]methyl]quinoline-6-carboxamide Formula: C28H30Cl2N4O2 MolecularWeight: 525.4694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Cl)CNC(=O)C4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C1CC(CN(C1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Cl)CNC(=O)C4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C28H30Cl2N4O2/c29-24-7-5-22(16-25(24)30)28(36)33-13-9-23(10-14-33)34-12-2-3-19(18-34)17-32-27(35)21-6-8-26-20(15-21)4-1-11-31-26/h1,4-8,11,15-16,19,23H,2-3,9-10,12-14,17-18H2,(H,32,35)