ethyl 3-[[1-(2-ethoxy-2-oxidanylidene-ethyl)benzotriazol-5-yl]amino]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[[1-(2-ethoxy-2-oxidanylidene-ethyl)benzotriazol-5-yl]amino]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[[1-(2-ethoxy-2-oxo-ethyl)benzotriazol-5-yl]amino]quinoxaline-2-carboxylate CAS Name: 3-[[1-(2-ethoxy-2-oxoethyl)-5-benzotriazolyl]amino]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(2-ethoxy-2-oxoethyl)benzotriazol-5-yl]amino]quinoxaline-2-carboxylate Traditional Name: 3-[[1-(2-ethoxy-2-keto-ethyl)benzotriazol-5-yl]amino]quinoxaline-2-carboxylic acid ethyl ester Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)NC3=NC4=CC=CC=C4N=C3C(=O)OCC)N=N1

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)NC3=NC4=CC=CC=C4N=C3C(=O)OCC)N=N1

InChI

InChI=1S/C21H20N6O4/c1-3-30-18(28)12-27-17-10-9-13(11-16(17)25-26-27)22-20-19(21(29)31-4-2)23-14-7-5-6-8-15(14)24-20/h5-11H,3-4,12H2,1-2H3,(H,22,24)