7-[3-(cyclopropylamino)-2-oxidanyl-propoxy]-2,3-diphenyl-chromen-4-one hydrochloride

Systemtic Name: 7-[3-(cyclopropylamino)-2-oxidanyl-propoxy]-2,3-diphenyl-chromen-4-one hydrochloride Openeye Name: 7-[3-(cyclopropylamino)-2-hydroxy-propoxy]-2,3-diphenyl-chromen-4-one hydrochloride CAS Name: 7-[3-(cyclopropylamino)-2-hydroxypropoxy]-2,3-diphenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 7-[3-(cyclopropylamino)-2-hydroxypropoxy]-2,3-diphenylchromen-4-one hydrochloride Traditional Name: 7-[3-(cyclopropylamino)-2-hydroxy-propoxy]-2,3-diphenyl-chromone hydrochloride Formula: C27H26ClNO4 MolecularWeight: 463.95264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC(COC2=CC3=C(C=C2)C(=O)C(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)O.Cl

Isomeric SMILES

C1CC1NCC(COC2=CC3=C(C=C2)C(=O)C(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)O.Cl

InChI

InChI=1S/C27H25NO4.ClH/c29-21(16-28-20-11-12-20)17-31-22-13-14-23-24(15-22)32-27(19-9-5-2-6-10-19)25(26(23)30)18-7-3-1-4-8-18;/h1-10,13-15,20-21,28-29H,11-12,16-17H2;1H