8-[2-oxidanyl-3-(phenethylamino)propoxy]-3-phenyl-chromen-4-one hydrochloride

Systemtic Name: 8-[2-oxidanyl-3-(phenethylamino)propoxy]-3-phenyl-chromen-4-one hydrochloride Openeye Name: 8-[2-hydroxy-3-(phenethylamino)propoxy]-3-phenyl-chromen-4-one hydrochloride CAS Name: 8-[2-hydroxy-3-(phenethylamino)propoxy]-3-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 8-[2-hydroxy-3-(phenethylamino)propoxy]-3-phenylchromen-4-one hydrochloride Traditional Name: 8-[2-hydroxy-3-(phenethylamino)propoxy]-3-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=C2OC=C(C3=O)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(COC2=CC=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O.Cl

InChI

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