5-[2-oxidanyl-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride

Systemtic Name: 5-[2-oxidanyl-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 5-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 5-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 5-[2-hydroxy-3-(phenethylamino)propoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 5-[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=CC=CC3=C2C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(COC2=CC=CC3=C2C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

InChI

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