ethyl 2-[[2-[(3-methylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]oxy]ethanoate

Systemtic Name: ethyl 2-[[2-[(3-methylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]oxy]ethanoate Openeye Name: ethyl 2-[[2-(m-tolylmethyl)-1-oxo-3,4-dihydroisoquinolin-5-yl]oxy]acetate CAS Name: 2-[[2-[(3-methylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(3-methylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]oxy]acetate Traditional Name: 2-[[1-keto-2-(3-methylbenzyl)-3,4-dihydroisoquinolin-5-yl]oxy]acetic acid ethyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=CC2=C1CCN(C2=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)COC1=CC=CC2=C1CCN(C2=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C21H23NO4/c1-3-25-20(23)14-26-19-9-5-8-18-17(19)10-11-22(21(18)24)13-16-7-4-6-15(2)12-16/h4-9,12H,3,10-11,13-14H2,1-2H3