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

Systemtic Name: 6-[3-[(3,4-diethoxyphenyl)methylamino]-2-oxidanyl-propoxy]-1H-quinolin-2-one hydrochloride Openeye Name: 6-[3-[(3,4-diethoxyphenyl)methylamino]-2-hydroxy-propoxy]-1H-quinolin-2-one hydrochloride CAS Name: 6-[3-[(3,4-diethoxyphenyl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[3-[(3,4-diethoxyphenyl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one hydrochloride Traditional Name: 6-[3-[(3,4-diethoxybenzyl)amino]-2-hydroxy-propoxy]carbostyril hydrochloride Formula: C23H29ClN2O5 MolecularWeight: 448.93976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O)OCC.Cl

InChI

InChI=1S/C23H28N2O5.ClH/c1-3-28-21-9-5-16(11-22(21)29-4-2)13-24-14-18(26)15-30-19-7-8-20-17(12-19)6-10-23(27)25-20;/h5-12,18,24,26H,3-4,13-15H2,1-2H3,(H,25,27);1H