[6-methyl-5-oxidanyl-7,8-bis(oxidanylidene)isoquinolin-1-yl]methyl (Z)-2-methylbut-2-enoate

Systemtic Name: [6-methyl-5-oxidanyl-7,8-bis(oxidanylidene)isoquinolin-1-yl]methyl (Z)-2-methylbut-2-enoate Openeye Name: (5-hydroxy-6-methyl-7,8-dioxo-1-isoquinolyl)methyl (Z)-2-methylbut-2-enoate CAS Name: (Z)-2-methyl-2-butenoic acid (5-hydroxy-6-methyl-7,8-dioxo-1-isoquinolinyl)methyl ester IUPAC Name: (5-hydroxy-6-methyl-7,8-dioxoisoquinolin-1-yl)methyl (Z)-2-methylbut-2-enoate Traditional Name: (Z)-2-methylbut-2-enoic acid (5-hydroxy-7,8-diketo-6-methyl-1-isoquinolyl)methyl ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)OCC1=NC=CC2=C1C(=O)C(=O)C(=C2O)C

Isomeric SMILES

C/C=C(/C)\C(=O)OCC1=NC=CC2=C1C(=O)C(=O)C(=C2O)C

InChI

InChI=1S/C16H15NO5/c1-4-8(2)16(21)22-7-11-12-10(5-6-17-11)13(18)9(3)14(19)15(12)20/h4-6,18H,7H2,1-3H3/b8-4-