6-[2-oxidanyl-3-[(3,4,5-trimethoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one hydrochloride

Systemtic Name: 6-[2-oxidanyl-3-[(3,4,5-trimethoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one hydrochloride Openeye Name: 6-[2-hydroxy-3-[(3,4,5-trimethoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one hydrochloride CAS Name: 6-[2-hydroxy-3-[(3,4,5-trimethoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[2-hydroxy-3-[(3,4,5-trimethoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one hydrochloride Traditional Name: 6-[2-hydroxy-3-[(3,4,5-trimethoxybenzyl)amino]propoxy]carbostyril hydrochloride Formula: C22H27ClN2O6 MolecularWeight: 450.91258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O.Cl

InChI

InChI=1S/C22H26N2O6.ClH/c1-27-19-8-14(9-20(28-2)22(19)29-3)11-23-12-16(25)13-30-17-5-6-18-15(10-17)4-7-21(26)24-18;/h4-10,16,23,25H,11-13H2,1-3H3,(H,24,26);1H