(Z)-(2-cyanoethanoylamino)-[1-(7-methoxy-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethylidene]azanium

Systemtic Name: (Z)-(2-cyanoethanoylamino)-[1-(7-methoxy-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethylidene]azanium Openeye Name: (Z)-[(2-cyanoacetyl)amino]-[1-(1-hydroxy-7-methoxy-4-oxo-quinoxalin-4-ium-2-yl)ethylidene]ammonium CAS Name: (Z)-[(2-cyano-1-oxoethyl)amino]-[1-(1-hydroxy-7-methoxy-4-oxo-2-quinoxalin-4-iumyl)ethylidene]ammonium IUPAC Name: (Z)-[(2-cyanoacetyl)amino]-[1-(1-hydroxy-7-methoxy-4-oxoquinoxalin-4-ium-2-yl)ethylidene]azanium Traditional Name: (Z)-[(2-cyanoacetyl)amino]-[1-(1-hydroxy-4-keto-7-methoxy-quinoxalin-4-ium-2-yl)ethylidene]ammonium Formula: C14H15N5O4+2 MolecularWeight: 317.3

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=[NH+]NC(=O)CC#N)C1=C[N+](=O)C2=C(N1O)C=C(C=C2)OC

Isomeric SMILES

C/C(=[NH+]/NC(=O)CC#N)/C1=C[N+](=O)C2=C(N1O)C=C(C=C2)OC

InChI

InChI=1S/C14H13N5O4/c1-9(16-17-14(20)5-6-15)13-8-18(21)11-4-3-10(23-2)7-12(11)19(13)22/h3-4,7-8,22H,5H2,1-2H3/p+2