ethyl 2,5-dimethyl-4-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(4-keto-1,2,3-benzotriazin-3-yl)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN2C(=O)C3=CC=CC=C3N=N2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN2C(=O)C3=CC=CC=C3N=N2)C)C

InChI

InChI=1S/C18H18N4O4/c1-4-26-18(25)16-11(3)19-10(2)15(16)14(23)9-22-17(24)12-7-5-6-8-13(12)20-21-22/h5-8,19H,4,9H2,1-3H3