3-[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-7-(methylamino)-1-phenyl-heptan-3-ol

Systemtic Name: 3-[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-7-(methylamino)-1-phenyl-heptan-3-ol Openeye Name: 3-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]-7-(methylamino)-1-phenyl-heptan-3-ol CAS Name: 3-[(6-bromo-2-methoxy-3-quinolinyl)-phenylmethyl]-7-(methylamino)-1-phenyl-3-heptanol IUPAC Name: 3-[(6-bromo-2-methoxyquinolin-3-yl)-phenylmethyl]-7-(methylamino)-1-phenylheptan-3-ol Traditional Name: 3-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]-7-(methylamino)-1-phenyl-heptan-3-ol Formula: C31H35BrN2O2 MolecularWeight: 547.5258

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCC(CCC1=CC=CC=C1)(C(C2=CC=CC=C2)C3=C(N=C4C=CC(=CC4=C3)Br)OC)O

Isomeric SMILES

CNCCCCC(CCC1=CC=CC=C1)(C(C2=CC=CC=C2)C3=C(N=C4C=CC(=CC4=C3)Br)OC)O

InChI

InChI=1S/C31H35BrN2O2/c1-33-20-10-9-18-31(35,19-17-23-11-5-3-6-12-23)29(24-13-7-4-8-14-24)27-22-25-21-26(32)15-16-28(25)34-30(27)36-2/h3-8,11-16,21-22,29,33,35H,9-10,17-20H2,1-2H3