5-acetamido-1-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]naphthalen-2-olate; chromium(2+)

Systemtic Name: 5-acetamido-1-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]naphthalen-2-olate; chromium(2+) Openeye Name: chromous 5-acetamido-1-(2-oxido-5-sulfamoyl-phenyl)azo-naphthalen-2-olate CAS Name: 5-acetamido-1-(2-oxido-5-sulfamoylphenyl)azo-2-naphthalenolate; chromium(2+) IUPAC Name: 5-acetamido-1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate; chromium(2+) Traditional Name: chromous 5-acetamido-1-(2-oxido-5-sulfamoyl-phenyl)azo-naphthalen-2-olate Formula: C18H14CrN4O5S MolecularWeight: 450.38866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC2=C1C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+2]

Isomeric SMILES

CC(=O)NC1=CC=CC2=C1C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+2]

InChI

InChI=1S/C18H16N4O5S.Cr/c1-10(23)20-14-4-2-3-13-12(14)6-8-17(25)18(13)22-21-15-9-11(28(19,26)27)5-7-16(15)24;/h2-9,24-25H,1H3,(H,20,23)(H2,19,26,27);/q;+2/p-2