4-[[5-methoxy-2-methyl-4-[[(6Z)-5-oxidanylidene-6-(phenylhydrazinylidene)-7-sulfo-naphthalen-2-yl]carbamoylamino]phenyl]diazenyl]-5-(phenylsulfonyloxy)naphthalene-2,7-disulfonic acid

Systemtic Name: 4-[[5-methoxy-2-methyl-4-[[(6Z)-5-oxidanylidene-6-(phenylhydrazinylidene)-7-sulfo-naphthalen-2-yl]carbamoylamino]phenyl]diazenyl]-5-(phenylsulfonyloxy)naphthalene-2,7-disulfonic acid Openeye Name: 4-(benzenesulfonyloxy)-5-[5-methoxy-2-methyl-4-[[(6Z)-5-oxo-6-(phenylhydrazono)-7-sulfo-2-naphthyl]carbamoylamino]phenyl]azo-naphthalene-2,7-disulfonic acid CAS Name: 4-(benzenesulfonyloxy)-5-[5-methoxy-2-methyl-4-[[oxo-[[(6Z)-5-oxo-6-(phenylhydrazinylidene)-7-sulfo-2-naphthalenyl]amino]methyl]amino]phenyl]azonaphthalene-2,7-disulfonic acid IUPAC Name: 4-(benzenesulfonyloxy)-5-[[5-methoxy-2-methyl-4-[[(6Z)-5-oxo-6-(phenylhydrazinylidene)-7-sulfonaphthalen-2-yl]carbamoylamino]phenyl]diazenyl]naphthalene-2,7-disulfonic acid Traditional Name: 4-besyloxy-5-[4-[[(6Z)-5-keto-6-(phenylhydrazono)-7-sulfo-2-naphthyl]carbamoylamino]-5-methoxy-2-methyl-phenyl]azo-naphthalene-2,7-disulfonic acid Formula: C41H32N6O15S4 MolecularWeight: 976.98398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)NC(=O)NC5=CC6=C(C=C5)C(=O)C(=NNC7=CC=CC=C7)C(=C6)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)NC(=O)NC5=CC6=C(C=C5)C(=O)/C(=N/NC7=CC=CC=C7)/C(=C6)S(=O)(=O)O

InChI

InChI=1S/C41H32N6O15S4/c1-23-15-33(43-41(49)42-27-13-14-31-24(16-27)19-37(65(56,57)58)39(40(31)48)47-44-26-9-5-3-6-10-26)35(61-2)22-32(23)45-46-34-20-29(63(50,51)52)17-25-18-30(64(53,54)55)21-36(38(25)34)62-66(59,60)28-11-7-4-8-12-28/h3-22,44H,1-2H3,(H2,42,43,49)(H,50,51,52)(H,53,54,55)(H,56,57,58)/b46-45?,47-39+