7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one

Systemtic Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one Openeye Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one CAS Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-3-(4-methoxyphenyl)-2-methyl-1-benzopyran-4-one IUPAC Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-3-(4-methoxyphenyl)-2-methylchromen-4-one Traditional Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-3-(4-methoxyphenyl)-2-methyl-chromone Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(CN3CCC4=CC=CC=C4C3)O)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(CN3CCC4=CC=CC=C4C3)O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H29NO5/c1-19-28(21-7-9-24(33-2)10-8-21)29(32)26-12-11-25(15-27(26)35-19)34-18-23(31)17-30-14-13-20-5-3-4-6-22(20)16-30/h3-12,15,23,31H,13-14,16-18H2,1-2H3