[2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-8-yl] 2-methylpropanoate hydrochloride

Systemtic Name: [2-oxidanylidene-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-8-yl] 2-methylpropanoate hydrochloride Openeye Name: [5-[1-hydroxy-2-(isopropylamino)butyl]-2-oxo-1H-quinolin-8-yl] 2-methylpropanoate hydrochloride CAS Name: 2-methylpropanoic acid [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-1H-quinolin-8-yl] ester hydrochloride IUPAC Name: [5-[1-hydroxy-2-(propan-2-ylamino)butyl]-2-oxo-1H-quinolin-8-yl] 2-methylpropanoate hydrochloride Traditional Name: 2-methylpropionic acid [5-[1-hydroxy-2-(isopropylamino)butyl]-2-keto-1H-quinolin-8-yl] ester hydrochloride Formula: C20H29ClN2O4 MolecularWeight: 396.90826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C(C)C)O)NC(C)C.Cl

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C(C)C)O)NC(C)C.Cl

InChI

InChI=1S/C20H28N2O4.ClH/c1-6-15(21-12(4)5)19(24)14-7-9-16(26-20(25)11(2)3)18-13(14)8-10-17(23)22-18;/h7-12,15,19,21,24H,6H2,1-5H3,(H,22,23);1H