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

Systemtic Name: 6-[3-[(3,5-dimethoxyphenyl)methylamino]-2-oxidanyl-propoxy]-1H-quinolin-2-one hydrochloride Openeye Name: 6-[3-[(3,5-dimethoxyphenyl)methylamino]-2-hydroxy-propoxy]-1H-quinolin-2-one hydrochloride CAS Name: 6-[3-[(3,5-dimethoxyphenyl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[3-[(3,5-dimethoxyphenyl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one hydrochloride Traditional Name: 6-[3-[(3,5-dimethoxybenzyl)amino]-2-hydroxy-propoxy]carbostyril hydrochloride Formula: C21H25ClN2O5 MolecularWeight: 420.8866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O)OC.Cl

Isomeric SMILES

COC1=CC(=CC(=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O)OC.Cl

InChI

InChI=1S/C21H24N2O5.ClH/c1-26-18-7-14(8-19(10-18)27-2)11-22-12-16(24)13-28-17-4-5-20-15(9-17)3-6-21(25)23-20;/h3-10,16,22,24H,11-13H2,1-2H3,(H,23,25);1H