8-oxidanyl-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-2-one hydrate hydrochloride

Systemtic Name: 8-oxidanyl-5-[1-oxidanyl-2-(propan-2-ylamino)butyl]-1H-quinolin-2-one hydrate hydrochloride Openeye Name: 8-hydroxy-5-[1-hydroxy-2-(isopropylamino)butyl]-1H-quinolin-2-one hydrate hydrochloride CAS Name: 8-hydroxy-5-[1-hydroxy-2-(propan-2-ylamino)butyl]-1H-quinolin-2-one hydrate hydrochloride IUPAC Name: 8-hydroxy-5-[1-hydroxy-2-(propan-2-ylamino)butyl]-1H-quinolin-2-one hydrate hydrochloride Traditional Name: 8-hydroxy-5-[1-hydroxy-2-(isopropylamino)butyl]carbostyril hydrate hydrochloride Formula: C16H25ClN2O4 MolecularWeight: 344.8337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3.ClH.H2O/c1-4-12(17-9(2)3)16(21)11-5-7-13(19)15-10(11)6-8-14(20)18-15;;/h5-9,12,16-17,19,21H,4H2,1-3H3,(H,18,20);1H;1H2