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

Systemtic Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]-4-methyl-chromen-2-one Openeye Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-4-methyl-chromen-2-one CAS Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]-4-methylchromen-2-one Traditional Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]-4-methyl-coumarin Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCC4=CC=CC=C4C3)O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCC4=CC=CC=C4C3)O

InChI

InChI=1S/C22H23NO4/c1-15-10-22(25)27-21-11-19(6-7-20(15)21)26-14-18(24)13-23-9-8-16-4-2-3-5-17(16)12-23/h2-7,10-11,18,24H,8-9,12-14H2,1H3