copper; 4-azanyl-5-oxidanidyl-6-[[2-oxidanidyl-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate; hydron

Systemtic Name: copper; 4-azanyl-5-oxidanidyl-6-[[2-oxidanidyl-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate; hydron Openeye Name: copper; 4-amino-5-oxido-6-[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]azo-naphthalene-1,7-disulfonate; hydron CAS Name: copper; 4-amino-5-oxido-6-[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]azonaphthalene-1,7-disulfonate; hydron IUPAC Name: copper; 4-amino-5-oxido-6-[[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate; hydron Traditional Name: cupric; 4-amino-5-oxido-6-[2-oxido-4-(2-sulfatoethylsulfonyl)phenyl]azo-naphthalene-1,7-disulfonate; hydron Formula: C18H15CuN3O14S4 MolecularWeight: 689.1294

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=CC(=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-].[Cu+2]

Isomeric SMILES

[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=CC(=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-].[Cu+2]

InChI

InChI=1S/C18H17N3O14S4.Cu/c19-11-2-4-14(37(26,27)28)10-8-15(38(29,30)31)17(18(23)16(10)11)21-20-12-3-1-9(7-13(12)22)36(24,25)6-5-35-39(32,33)34;/h1-4,7-8,22-23H,5-6,19H2,(H,26,27,28)(H,29,30,31)(H,32,33,34);/q;+2/p-2