5-[[1,3-bis(oxidaniumylidene)-1-phenylazanyl-butan-2-yl]hydrazinylidene]-3-nitro-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonate; chromium

Systemtic Name: 5-[[1,3-bis(oxidaniumylidene)-1-phenylazanyl-butan-2-yl]hydrazinylidene]-3-nitro-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonate; chromium Openeye Name: 5-[[1-[anilino(oxoniumylidene)methyl]-2-oxoniumylidene-propyl]hydrazono]-3-nitro-6-oxo-cyclohexa-1,3-diene-1-sulfonate; chromium CAS Name: 5-[(1-anilino-1,3-dioxoniumylidenebutan-2-yl)hydrazinylidene]-3-nitro-6-oxo-1-cyclohexa-1,3-dienesulfonate; chromium IUPAC Name: 5-[(1-anilino-1,3-dioxoniumylidenebutan-2-yl)hydrazinylidene]-3-nitro-6-oxocyclohexa-1,3-diene-1-sulfonate; chromium Traditional Name: 5-[[1-[anilino(oxoniumylidene)methyl]-2-oxoniumylidene-propyl]hydrazono]-6-keto-3-nitro-cyclohexa-1,3-diene-1-sulfonate; chromium Formula: C16H15CrN4O8S+ MolecularWeight: 475.3734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=[OH+])C(C(=[OH+])NC1=CC=CC=C1)NN=C2C=C(C=C(C2=O)S(=O)(=O)[O-])[N+](=O)[O-].[Cr]

Isomeric SMILES

CC(=[OH+])C(C(=[OH+])NC1=CC=CC=C1)NN=C2C=C(C=C(C2=O)S(=O)(=O)[O-])[N+](=O)[O-].[Cr]

InChI

InChI=1S/C16H14N4O8S.Cr/c1-9(21)14(16(23)17-10-5-3-2-4-6-10)19-18-12-7-11(20(24)25)8-13(15(12)22)29(26,27)28;/h2-8,14,19H,1H3,(H,17,23)(H,26,27,28);/p+1