sodium; chromium(3+); 4-[[3-methyl-5-oxidanidyl-1-(3-sulfonatophenyl)pyrazol-4-yl]diazenyl]-3-oxidanidyl-naphthalene-1-sulfonate

Systemtic Name: sodium; chromium(3+); 4-[[3-methyl-5-oxidanidyl-1-(3-sulfonatophenyl)pyrazol-4-yl]diazenyl]-3-oxidanidyl-naphthalene-1-sulfonate Openeye Name: chromic sodium 4-[3-methyl-5-oxido-1-(3-sulfonatophenyl)pyrazol-4-yl]azo-3-oxido-naphthalene-1-sulfonate CAS Name: sodium; chromium(3+); 4-[[3-methyl-5-oxido-1-(3-sulfonatophenyl)-4-pyrazolyl]azo]-3-oxido-1-naphthalenesulfonate IUPAC Name: sodium; chromium(3+); 4-[[3-methyl-5-oxido-1-(3-sulfonatophenyl)pyrazol-4-yl]diazenyl]-3-oxidonaphthalene-1-sulfonate Traditional Name: chromic sodium 4-[3-methyl-5-oxido-1-(3-sulfonatophenyl)pyrazol-4-yl]azo-3-oxido-naphthalene-1-sulfonate Formula: C20H12CrN4NaO8S2 MolecularWeight: 575.44715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC(=CC=C4)S(=O)(=O)[O-].[Na+].[Cr+3]

Isomeric SMILES

CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC(=CC=C4)S(=O)(=O)[O-].[Na+].[Cr+3]

InChI

InChI=1S/C20H16N4O8S2.Cr.Na/c1-11-18(20(26)24(23-11)12-5-4-6-13(9-12)33(27,28)29)21-22-19-15-8-3-2-7-14(15)17(10-16(19)25)34(30,31)32;;/h2-10,25-26H,1H3,(H,27,28,29)(H,30,31,32);;/q;+3;+1/p-4