3-[(2,4-dimethoxyphenyl)methylamino]-1-(2-oxidanylpropoxy)quinolin-2-one hydrochloride

Systemtic Name: 3-[(2,4-dimethoxyphenyl)methylamino]-1-(2-oxidanylpropoxy)quinolin-2-one hydrochloride Openeye Name: 3-[(2,4-dimethoxyphenyl)methylamino]-1-(2-hydroxypropoxy)quinolin-2-one hydrochloride CAS Name: 3-[(2,4-dimethoxyphenyl)methylamino]-1-(2-hydroxypropoxy)-2-quinolinone hydrochloride IUPAC Name: 3-[(2,4-dimethoxyphenyl)methylamino]-1-(2-hydroxypropoxy)quinolin-2-one hydrochloride Traditional Name: 3-[(2,4-dimethoxybenzyl)amino]-1-(2-hydroxypropoxy)carbostyril hydrochloride Formula: C21H25ClN2O5 MolecularWeight: 420.8866

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Descriptors Computed from Structure

Canonical SMILES:

CC(CON1C2=CC=CC=C2C=C(C1=O)NCC3=C(C=C(C=C3)OC)OC)O.Cl

Isomeric SMILES

CC(CON1C2=CC=CC=C2C=C(C1=O)NCC3=C(C=C(C=C3)OC)OC)O.Cl

InChI

InChI=1S/C21H24N2O5.ClH/c1-14(24)13-28-23-19-7-5-4-6-15(19)10-18(21(23)25)22-12-16-8-9-17(26-2)11-20(16)27-3;/h4-11,14,22,24H,12-13H2,1-3H3;1H