2-(4-methylphenyl)-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]chromen-4-one hydrochloride

Systemtic Name: 2-(4-methylphenyl)-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]chromen-4-one hydrochloride Openeye Name: 7-[2-hydroxy-3-(isopropylamino)propoxy]-2-(p-tolyl)chromen-4-one hydrochloride CAS Name: 7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-(4-methylphenyl)-1-benzopyran-4-one hydrochloride IUPAC Name: 7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-(4-methylphenyl)chromen-4-one hydrochloride Traditional Name: 7-[2-hydroxy-3-(isopropylamino)propoxy]-2-(p-tolyl)chromone hydrochloride Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)OCC(CNC(C)C)O.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)OCC(CNC(C)C)O.Cl

InChI

InChI=1S/C22H25NO4.ClH/c1-14(2)23-12-17(24)13-26-18-8-9-19-20(25)11-21(27-22(19)10-18)16-6-4-15(3)5-7-16;/h4-11,14,17,23-24H,12-13H2,1-3H3;1H