[2-methanoyl-7-methoxy-6-methyl-5,8-bis(oxidanylidene)-1H-isoquinolin-1-yl]methyl propanoate

Systemtic Name: [2-methanoyl-7-methoxy-6-methyl-5,8-bis(oxidanylidene)-1H-isoquinolin-1-yl]methyl propanoate Openeye Name: (2-formyl-7-methoxy-6-methyl-5,8-dioxo-1H-isoquinolin-1-yl)methyl propanoate CAS Name: propanoic acid (2-formyl-7-methoxy-6-methyl-5,8-dioxo-1H-isoquinolin-1-yl)methyl ester IUPAC Name: (2-formyl-7-methoxy-6-methyl-5,8-dioxo-1H-isoquinolin-1-yl)methyl propanoate Traditional Name: propionic acid (2-formyl-5,8-diketo-7-methoxy-6-methyl-1H-isoquinolin-1-yl)methyl ester Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1C2=C(C=CN1C=O)C(=O)C(=C(C2=O)OC)C

Isomeric SMILES

CCC(=O)OCC1C2=C(C=CN1C=O)C(=O)C(=C(C2=O)OC)C

InChI

InChI=1S/C16H17NO6/c1-4-12(19)23-7-11-13-10(5-6-17(11)8-18)14(20)9(2)16(22-3)15(13)21/h5-6,8,11H,4,7H2,1-3H3