1-oxidanidyl-4-oxidanyl-3-(3,4,5-trimethoxyphenyl)imino-quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 1-oxidanidyl-4-oxidanyl-3-(3,4,5-trimethoxyphenyl)imino-quinoxalin-1-ium-2-carbonitrile Openeye Name: 4-hydroxy-1-oxido-3-(3,4,5-trimethoxyphenyl)imino-quinoxalin-1-ium-2-carbonitrile CAS Name: 4-hydroxy-1-oxido-3-(3,4,5-trimethoxyphenyl)imino-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 4-hydroxy-1-oxido-3-(3,4,5-trimethoxyphenyl)iminoquinoxalin-1-ium-2-carbonitrile Traditional Name: 4-hydroxy-1-oxido-3-(3,4,5-trimethoxyphenyl)imino-quinoxalin-1-ium-2-carbonitrile Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N=C2C(=[N+](C3=CC=CC=C3N2O)[O-])C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N=C2C(=[N+](C3=CC=CC=C3N2O)[O-])C#N

InChI

InChI=1S/C18H16N4O5/c1-25-15-8-11(9-16(26-2)17(15)27-3)20-18-14(10-19)21(23)12-6-4-5-7-13(12)22(18)24/h4-9,24H,1-3H3