O4-ethyl O2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] ester IUPAC Name: 4-O-ethyl 2-O-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(4-keto-1,2,3-benzotriazin-3-yl)methyl] ester Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)C

InChI

InChI=1S/C18H18N4O5/c1-4-26-17(24)14-10(2)15(19-11(14)3)18(25)27-9-22-16(23)12-7-5-6-8-13(12)20-21-22/h5-8,19H,4,9H2,1-3H3