8-oxidanyl-5-[[3-[[(4-oxidanyl-6-sulfo-naphthalen-1-yl)amino]methyl]phenyl]methylamino]naphthalene-2-sulfonic acid

Systemtic Name: 8-oxidanyl-5-[[3-[[(4-oxidanyl-6-sulfo-naphthalen-1-yl)amino]methyl]phenyl]methylamino]naphthalene-2-sulfonic acid Openeye Name: 8-hydroxy-5-[[3-[[(4-hydroxy-6-sulfo-1-naphthyl)amino]methyl]phenyl]methylamino]naphthalene-2-sulfonic acid CAS Name: 8-hydroxy-5-[[3-[[(4-hydroxy-6-sulfo-1-naphthalenyl)amino]methyl]phenyl]methylamino]-2-naphthalenesulfonic acid IUPAC Name: 8-hydroxy-5-[[3-[[(4-hydroxy-6-sulfonaphthalen-1-yl)amino]methyl]phenyl]methylamino]naphthalene-2-sulfonic acid Traditional Name: 8-hydroxy-5-[[3-[[(4-hydroxy-6-sulfo-1-naphthyl)amino]methyl]benzyl]amino]naphthalene-2-sulfonic acid Formula: C28H24N2O8S2 MolecularWeight: 580.62876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=C3C=CC(=CC3=C(C=C2)O)S(=O)(=O)O)CNC4=C5C=CC(=CC5=C(C=C4)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=C3C=CC(=CC3=C(C=C2)O)S(=O)(=O)O)CNC4=C5C=CC(=CC5=C(C=C4)O)S(=O)(=O)O

InChI

InChI=1S/C28H24N2O8S2/c31-27-10-8-25(21-6-4-19(13-23(21)27)39(33,34)35)29-15-17-2-1-3-18(12-17)16-30-26-9-11-28(32)24-14-20(40(36,37)38)5-7-22(24)26/h1-14,29-32H,15-16H2,(H,33,34,35)(H,36,37,38)