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

Systemtic Name: 8-bromanyl-7-methoxy-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]quinoline-4-carboxamide Openeye Name: 8-bromo-7-methoxy-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[[4-(1-piperidyl)-1-piperidyl]methyl]quinoline-4-carboxamide CAS Name: 8-bromo-7-methoxy-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-4-quinolinecarboxamide IUPAC Name: 8-bromo-7-methoxy-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]quinoline-4-carboxamide Traditional Name: 8-bromo-7-methoxy-2-phenyl-N-[(1S)-1-phenylpropyl]-3-[(4-piperidinopiperidino)methyl]cinchoninamide Formula: C37H43BrN4O2 MolecularWeight: 655.66692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C3C=CC(=C(C3=NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6)Br)OC

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C3C=CC(=C(C3=NC(=C2CN4CCC(CC4)N5CCCCC5)C6=CC=CC=C6)Br)OC

InChI

InChI=1S/C37H43BrN4O2/c1-3-31(26-13-7-4-8-14-26)39-37(43)33-29-17-18-32(44-2)34(38)36(29)40-35(27-15-9-5-10-16-27)30(33)25-41-23-19-28(20-24-41)42-21-11-6-12-22-42/h4-5,7-10,13-18,28,31H,3,6,11-12,19-25H2,1-2H3,(H,39,43)/t31-/m0/s1