ethyl 2-[5-[(6-chloranyl-3-methyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-[(6-chloranyl-3-methyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]ethanoate Openeye Name: ethyl 2-[5-[(6-chloro-1-hydroxy-3-methyl-4-oxido-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetate CAS Name: 2-[5-[(6-chloro-1-hydroxy-3-methyl-4-oxido-2-quinoxalin-4-iumylidene)amino]-1-benzotriazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(6-chloro-1-hydroxy-3-methyl-4-oxidoquinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetate Traditional Name: 2-[5-[(6-chloro-1-hydroxy-3-methyl-4-oxido-quinoxalin-4-ium-2-ylidene)amino]benzotriazol-1-yl]acetic acid ethyl ester Formula: C19H17ClN6O4 MolecularWeight: 428.82908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN6O4/c1-3-30-18(27)10-24-15-7-5-13(9-14(15)22-23-24)21-19-11(2)25(28)17-8-12(20)4-6-16(17)26(19)29/h4-9,29H,3,10H2,1-2H3