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

Systemtic Name: 8-chloranyl-7-oxidanylidene-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1H-quinoline-4-carboxamide Openeye Name: 8-chloro-7-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[[4-(1-piperidyl)-1-piperidyl]methyl]-1H-quinoline-4-carboxamide CAS Name: 8-chloro-7-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-1H-quinoline-4-carboxamide IUPAC Name: 8-chloro-7-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1H-quinoline-4-carboxamide Traditional Name: 8-chloro-7-keto-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidinopiperidino)methyl]-1H-quinoline-4-carboxamide Formula: C36H41ClN4O2 MolecularWeight: 597.18934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C3C=CC(=O)C(=C3NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6)Cl

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C3C=CC(=O)C(=C3NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6)Cl

InChI

InChI=1S/C36H41ClN4O2/c1-2-30(25-12-6-3-7-13-25)38-36(43)32-28-16-17-31(42)33(37)35(28)39-34(26-14-8-4-9-15-26)29(32)24-40-22-18-27(19-23-40)41-20-10-5-11-21-41/h3-4,6-9,12-17,27,30,39H,2,5,10-11,18-24H2,1H3,(H,38,43)/t30-/m0/s1