1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-2-methyl-isoquinolin-3-one

Systemtic Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-2-methyl-isoquinolin-3-one Openeye Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-2-methyl-isoquinolin-3-one CAS Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-2-methyl-3-isoquinolinone IUPAC Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-2-methylisoquinolin-3-one Traditional Name: 1-(3,4-diethoxybenzyl)-6,7-diethoxy-2-methyl-3-isoquinolone Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2=C3C=C(C(=CC3=CC(=O)N2C)OCC)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2=C3C=C(C(=CC3=CC(=O)N2C)OCC)OCC)OCC

InChI

InChI=1S/C25H31NO5/c1-6-28-21-11-10-17(13-22(21)29-7-2)12-20-19-16-24(31-9-4)23(30-8-3)14-18(19)15-25(27)26(20)5/h10-11,13-16H,6-9,12H2,1-5H3