3-azanyl-4-[[4-[4-[(2-azanyl-3,6-disulfo-naphthalen-1-yl)diazenyl]-3-sulfo-phenyl]phenyl]diazenyl]naphthalene-2,7-disulfonic acid

Systemtic Name: 3-azanyl-4-[[4-[4-[(2-azanyl-3,6-disulfo-naphthalen-1-yl)diazenyl]-3-sulfo-phenyl]phenyl]diazenyl]naphthalene-2,7-disulfonic acid Openeye Name: 3-amino-4-[4-[4-[(2-amino-3,6-disulfo-1-naphthyl)azo]-3-sulfo-phenyl]phenyl]azo-naphthalene-2,7-disulfonic acid CAS Name: 3-amino-4-[4-[4-[(2-amino-3,6-disulfo-1-naphthalenyl)azo]-3-sulfophenyl]phenyl]azonaphthalene-2,7-disulfonic acid IUPAC Name: 3-amino-4-[[4-[4-[(2-amino-3,6-disulfonaphthalen-1-yl)diazenyl]-3-sulfophenyl]phenyl]diazenyl]naphthalene-2,7-disulfonic acid Traditional Name: 3-amino-4-[4-[4-[(2-amino-3,6-disulfo-1-naphthyl)azo]-3-sulfo-phenyl]phenyl]azo-naphthalene-2,7-disulfonic acid Formula: C32H24N6O15S5 MolecularWeight: 892.88916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)N=NC5=C6C=CC(=CC6=CC(=C5N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)N=NC5=C6C=CC(=CC6=CC(=C5N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C32H24N6O15S5/c33-29-27(57(48,49)50)14-18-11-21(54(39,40)41)6-8-23(18)31(29)37-35-20-4-1-16(2-5-20)17-3-10-25(26(13-17)56(45,46)47)36-38-32-24-9-7-22(55(42,43)44)12-19(24)15-28(30(32)34)58(51,52)53/h1-15H,33-34H2,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)