6-methoxy-4-[(4-methyl-3-oxidanyl-phenyl)amino]-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile hydrochloride

Systemtic Name: 6-methoxy-4-[(4-methyl-3-oxidanyl-phenyl)amino]-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile hydrochloride Openeye Name: 4-(3-hydroxy-4-methyl-anilino)-6-methoxy-7-[3-(4-pyridyl)propoxy]quinoline-3-carbonitrile hydrochloride CAS Name: 4-(3-hydroxy-4-methylanilino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)-3-quinolinecarbonitrile hydrochloride IUPAC Name: 4-(3-hydroxy-4-methylanilino)-6-methoxy-7-(3-pyridin-4-ylpropoxy)quinoline-3-carbonitrile hydrochloride Traditional Name: 4-(3-hydroxy-4-methyl-anilino)-6-methoxy-7-[3-(4-pyridyl)propoxy]quinoline-3-carbonitrile hydrochloride Formula: C26H25ClN4O3 MolecularWeight: 476.9547

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C=NC3=CC(=C(C=C32)OC)OCCCC4=CC=NC=C4)C#N)O.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C=NC3=CC(=C(C=C32)OC)OCCCC4=CC=NC=C4)C#N)O.Cl

InChI

InChI=1S/C26H24N4O3.ClH/c1-17-5-6-20(12-23(17)31)30-26-19(15-27)16-29-22-14-25(24(32-2)13-21(22)26)33-11-3-4-18-7-9-28-10-8-18;/h5-10,12-14,16,31H,3-4,11H2,1-2H3,(H,29,30);1H