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

Systemtic Name: methyl 2-ethyl-4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-1,3-bis(oxidanylidene)isoquinoline-4-carboxylate Openeye Name: methyl 2-ethyl-4-[2-(methoxycarbonylamino)-2-oxo-ethyl]-1,3-dioxo-isoquinoline-4-carboxylate CAS Name: 2-ethyl-4-[2-(methoxycarbonylamino)-2-oxoethyl]-1,3-dioxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-[2-(methoxycarbonylamino)-2-oxoethyl]-1,3-dioxoisoquinoline-4-carboxylate Traditional Name: 4-[2-(carbomethoxyamino)-2-keto-ethyl]-2-ethyl-1,3-diketo-isoquinoline-4-carboxylic acid methyl ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

InChI

InChI=1S/C17H18N2O7/c1-4-19-13(21)10-7-5-6-8-11(10)17(14(19)22,15(23)25-2)9-12(20)18-16(24)26-3/h5-8H,4,9H2,1-3H3,(H,18,20,24)