8-oxidanyl-5-[(1R,2S)-1-oxidanyl-2-(propan-2-ylamino)butyl]-4aH-quinolin-2-one hydrochloride

Systemtic Name: 8-oxidanyl-5-[(1R,2S)-1-oxidanyl-2-(propan-2-ylamino)butyl]-4aH-quinolin-2-one hydrochloride Openeye Name: 8-hydroxy-5-[(1R,2S)-1-hydroxy-2-(isopropylamino)butyl]-4aH-quinolin-2-one hydrochloride CAS Name: 8-hydroxy-5-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]-4aH-quinolin-2-one hydrochloride IUPAC Name: 8-hydroxy-5-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]-4aH-quinolin-2-one hydrochloride Traditional Name: 8-hydroxy-5-[(1R,2S)-1-hydroxy-2-(isopropylamino)butyl]-4aH-quinolin-2-one hydrochloride Formula: C16H23ClN2O3 MolecularWeight: 326.81842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=C(C2=NC(=O)C=CC12)O)O)NC(C)C.Cl

Isomeric SMILES

CC[C@@H]([C@@H](C1=CC=C(C2=NC(=O)C=CC12)O)O)NC(C)C.Cl

InChI

InChI=1S/C16H22N2O3.ClH/c1-4-12(17-9(2)3)16(21)11-5-7-13(19)15-10(11)6-8-14(20)18-15;/h5-10,12,16-17,19,21H,4H2,1-3H3;1H/t10?,12-,16+;/m0./s1