1-butyl-3-[(E)-(1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-ylidene)methyl]imino-urea

Systemtic Name: 1-butyl-3-[(E)-(1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-ylidene)methyl]imino-urea Openeye Name: 1-butyl-3-[(E)-(4-hydroxy-1-oxido-quinoxalin-1-ium-6-ylidene)methyl]imino-urea CAS Name: 1-butyl-3-[(E)-(4-hydroxy-1-oxido-6-quinoxalin-1-iumylidene)methyl]iminourea IUPAC Name: 1-butyl-3-[(E)-(4-hydroxy-1-oxidoquinoxalin-1-ium-6-ylidene)methyl]iminourea Traditional Name: 1-butyl-3-[(E)-(4-hydroxy-1-oxido-quinoxalin-1-ium-6-ylidene)methyl]imino-urea Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N=NC=C1C=CC2=[N+](C=CN(C2=C1)O)[O-]

Isomeric SMILES

CCCCNC(=O)N=N/C=C/1\C=CC2=[N+](C=CN(C2=C1)O)[O-]

InChI

InChI=1S/C14H17N5O3/c1-2-3-6-15-14(20)17-16-10-11-4-5-12-13(9-11)19(22)8-7-18(12)21/h4-5,7-10,22H,2-3,6H2,1H3,(H,15,20)/b11-10+,17-16?