ethyl 2-[6-[(3,7-dimethyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[6-[(3,7-dimethyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]ethanoate Openeye Name: ethyl 2-[6-[(1-hydroxy-3,7-dimethyl-4-oxido-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetate CAS Name: 2-[6-[(1-hydroxy-3,7-dimethyl-4-oxido-2-quinoxalin-4-iumylidene)amino]-1-benzotriazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[(1-hydroxy-3,7-dimethyl-4-oxidoquinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetate Traditional Name: 2-[6-[(1-hydroxy-3,7-dimethyl-4-oxido-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetic acid ethyl ester Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC(=C2)N=C3C(=[N+](C4=C(N3O)C=C(C=C4)C)[O-])C)N=N1

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2)N=C3C(=[N+](C4=C(N3O)C=C(C=C4)C)[O-])C)N=N1

InChI

InChI=1S/C20H20N6O4/c1-4-30-19(27)11-24-17-10-14(6-7-15(17)22-23-24)21-20-13(3)25(28)16-8-5-12(2)9-18(16)26(20)29/h5-10,29H,4,11H2,1-3H3