ethyl (NE)-N-(6-chloranyl-3-cyano-7-methoxy-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)carbamate

Systemtic Name: ethyl (NE)-N-(6-chloranyl-3-cyano-7-methoxy-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-2-ylidene)carbamate Openeye Name: ethyl (NE)-N-(6-chloro-3-cyano-1-hydroxy-7-methoxy-4-oxido-quinoxalin-4-ium-2-ylidene)carbamate CAS Name: (NE)-N-(6-chloro-3-cyano-1-hydroxy-7-methoxy-4-oxido-2-quinoxalin-4-iumylidene)carbamic acid ethyl ester IUPAC Name: ethyl (NE)-N-(6-chloro-3-cyano-1-hydroxy-7-methoxy-4-oxidoquinoxalin-4-ium-2-ylidene)carbamate Traditional Name: (NE)-N-(6-chloro-3-cyano-1-hydroxy-7-methoxy-4-oxido-quinoxalin-4-ium-2-ylidene)carbamic acid ethyl ester Formula: C13H11ClN4O5 MolecularWeight: 338.70324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N=C1C(=[N+](C2=CC(=C(C=C2N1O)OC)Cl)[O-])C#N

Isomeric SMILES

CCOC(=O)/N=C/1\C(=[N+](C2=CC(=C(C=C2N1O)OC)Cl)[O-])C#N

InChI

InChI=1S/C13H11ClN4O5/c1-3-23-13(19)16-12-10(6-15)17(20)8-4-7(14)11(22-2)5-9(8)18(12)21/h4-5,21H,3H2,1-2H3/b16-12+