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

Systemtic Name: [6-methyl-7-(methylamino)-5,8-bis(oxidanylidene)isoquinolin-1-yl]methyl (Z)-2-methylbut-2-enoate Openeye Name: [6-methyl-7-(methylamino)-5,8-dioxo-1-isoquinolyl]methyl (Z)-2-methylbut-2-enoate CAS Name: (Z)-2-methyl-2-butenoic acid [6-methyl-7-(methylamino)-5,8-dioxo-1-isoquinolinyl]methyl ester IUPAC Name: [6-methyl-7-(methylamino)-5,8-dioxoisoquinolin-1-yl]methyl (Z)-2-methylbut-2-enoate Traditional Name: (Z)-2-methylbut-2-enoic acid [5,8-diketo-6-methyl-7-(methylamino)-1-isoquinolyl]methyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)OCC1=NC=CC2=C1C(=O)C(=C(C2=O)C)NC

Isomeric SMILES

C/C=C(/C)\C(=O)OCC1=NC=CC2=C1C(=O)C(=C(C2=O)C)NC

InChI

InChI=1S/C17H18N2O4/c1-5-9(2)17(22)23-8-12-13-11(6-7-19-12)15(20)10(3)14(18-4)16(13)21/h5-7,18H,8H2,1-4H3/b9-5-