methyl 2-(5-oxidanylidene-7,8-dihydro-6H-isoquinolin-6-yl)ethanoate

Systemtic Name: methyl 2-(5-oxidanylidene-7,8-dihydro-6H-isoquinolin-6-yl)ethanoate Openeye Name: methyl 2-(5-oxo-7,8-dihydro-6H-isoquinolin-6-yl)acetate CAS Name: 2-(5-oxo-7,8-dihydro-6H-isoquinolin-6-yl)acetic acid methyl ester IUPAC Name: methyl 2-(5-oxo-7,8-dihydro-6H-isoquinolin-6-yl)acetate Traditional Name: 2-(5-keto-7,8-dihydro-6H-isoquinolin-6-yl)acetic acid methyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCC2=C(C1=O)C=CN=C2

Isomeric SMILES

COC(=O)CC1CCC2=C(C1=O)C=CN=C2

InChI

InChI=1S/C12H13NO3/c1-16-11(14)6-8-2-3-9-7-13-5-4-10(9)12(8)15/h4-5,7-8H,2-3,6H2,1H3