tetrasodium 1-[(4-phosphonatophenyl)-sulfinato-amino]-4-[4-[(4-phosphonatophenyl)-sulfinato-amino]phenyl]benzene

Systemtic Name: tetrasodium 1-[(4-phosphonatophenyl)-sulfinato-amino]-4-[4-[(4-phosphonatophenyl)-sulfinato-amino]phenyl]benzene Openeye Name: tetrasodium 1-(4-phosphonato-N-sulfinato-anilino)-4-[4-(4-phosphonato-N-sulfinato-anilino)phenyl]benzene CAS Name: tetrasodium 1-(4-phosphonato-N-sulfinatoanilino)-4-[4-(4-phosphonato-N-sulfinatoanilino)phenyl]benzene IUPAC Name: tetrasodium 1-(4-phosphonato-N-sulfinatoanilino)-4-[4-(4-phosphonato-N-sulfinatoanilino)phenyl]benzene Traditional Name: tetrasodium 1-(4-phosphonato-N-sulfinato-anilino)-4-[4-(4-phosphonato-N-sulfinato-anilino)phenyl]benzene Formula: C24H16N2Na4O10P2S2-2 MolecularWeight: 710.427842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)N(C3=CC=C(C=C3)P(=O)([O-])[O-])S(=O)[O-])N(C4=CC=C(C=C4)P(=O)([O-])[O-])S(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)N(C3=CC=C(C=C3)P(=O)([O-])[O-])S(=O)[O-])N(C4=CC=C(C=C4)P(=O)([O-])[O-])S(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C24H22N2O10P2S2.4Na/c27-37(28,29)23-13-9-21(10-14-23)25(39(33)34)19-5-1-17(2-6-19)18-3-7-20(8-4-18)26(40(35)36)22-11-15-24(16-12-22)38(30,31)32;;;;/h1-16H,(H,33,34)(H,35,36)(H2,27,28,29)(H2,30,31,32);;;;/q;4*+1/p-6