ethyl 5-(3-methoxyphenyl)-3-(1-oxidanyl-3-oxidanylidene-4H-1,2,4-benzotriazin-2-yl)-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(3-methoxyphenyl)-3-(1-oxidanyl-3-oxidanylidene-4H-1,2,4-benzotriazin-2-yl)-1H-pyrazole-4-carboxylate Openeye Name: ethyl 3-(1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)-5-(3-methoxyphenyl)-1H-pyrazole-4-carboxylate CAS Name: 3-(1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)-5-(3-methoxyphenyl)-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1-hydroxy-3-oxo-4H-1,2,4-benzotriazin-2-yl)-5-(3-methoxyphenyl)-1H-pyrazole-4-carboxylate Traditional Name: 3-(1-hydroxy-3-keto-4H-1,2,4-benzotriazin-2-yl)-5-(3-methoxyphenyl)-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C20H19N5O5 MolecularWeight: 409.39536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1N2C(=O)NC3=CC=CC=C3N2O)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(NN=C1N2C(=O)NC3=CC=CC=C3N2O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C20H19N5O5/c1-3-30-19(26)16-17(12-7-6-8-13(11-12)29-2)22-23-18(16)24-20(27)21-14-9-4-5-10-15(14)25(24)28/h4-11,28H,3H2,1-2H3,(H,21,27)(H,22,23)