methyl 7-methoxy-4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-2-methyl-1,3-bis(oxidanylidene)isoquinoline-4-carboxylate

Systemtic Name: methyl 7-methoxy-4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-2-methyl-1,3-bis(oxidanylidene)isoquinoline-4-carboxylate Openeye Name: methyl 7-methoxy-4-[2-(methoxycarbonylamino)-2-oxo-ethyl]-2-methyl-1,3-dioxo-isoquinoline-4-carboxylate CAS Name: 7-methoxy-4-[2-(methoxycarbonylamino)-2-oxoethyl]-2-methyl-1,3-dioxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-4-[2-(methoxycarbonylamino)-2-oxoethyl]-2-methyl-1,3-dioxoisoquinoline-4-carboxylate Traditional Name: 4-[2-(carbomethoxyamino)-2-keto-ethyl]-1,3-diketo-7-methoxy-2-methyl-isoquinoline-4-carboxylic acid methyl ester Formula: C17H18N2O8 MolecularWeight: 378.33342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CC(=C2)OC)C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=C(C=CC(=C2)OC)C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

InChI

InChI=1S/C17H18N2O8/c1-19-13(21)10-7-9(25-2)5-6-11(10)17(14(19)22,15(23)26-3)8-12(20)18-16(24)27-4/h5-7H,8H2,1-4H3,(H,18,20,24)