N-[(1S)-1-cyclohexylethyl]-7-oxidanylidene-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1H-quinoline-4-carboxamide

Systemtic Name: N-[(1S)-1-cyclohexylethyl]-7-oxidanylidene-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1H-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-cyclohexylethyl]-7-oxo-2-phenyl-3-[[4-(1-piperidyl)-1-piperidyl]methyl]-1H-quinoline-4-carboxamide CAS Name: N-[(1S)-1-cyclohexylethyl]-7-oxo-2-phenyl-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-1H-quinoline-4-carboxamide IUPAC Name: N-[(1S)-1-cyclohexylethyl]-7-oxo-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1H-quinoline-4-carboxamide Traditional Name: N-[(1S)-1-cyclohexylethyl]-7-keto-2-phenyl-3-[(4-piperidinopiperidino)methyl]-1H-quinoline-4-carboxamide Formula: C35H46N4O2 MolecularWeight: 554.76534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=C3C=CC(=O)C=C3NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6

Isomeric SMILES

C[C@@H](C1CCCCC1)NC(=O)C2=C3C=CC(=O)C=C3NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6

InChI

InChI=1S/C35H46N4O2/c1-25(26-11-5-2-6-12-26)36-35(41)33-30-16-15-29(40)23-32(30)37-34(27-13-7-3-8-14-27)31(33)24-38-21-17-28(18-22-38)39-19-9-4-10-20-39/h3,7-8,13-16,23,25-26,28,37H,2,4-6,9-12,17-22,24H2,1H3,(H,36,41)/t25-/m0/s1