7-[2-oxidanyl-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride

Systemtic Name: 7-[2-oxidanyl-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 7-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 7-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 7-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 7-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenyl-chromone hydrochloride Formula: C26H26ClNO4 MolecularWeight: 451.94194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C26H25NO4.ClH/c28-21(17-27-14-13-19-7-3-1-4-8-19)18-30-22-11-12-23-24(29)16-25(31-26(23)15-22)20-9-5-2-6-10-20;/h1-12,15-16,21,27-28H,13-14,17-18H2;1H