(3E)-5-benzamido-4-oxidanylidene-3-[(1-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-5-benzamido-4-oxidanylidene-3-[(1-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2,7-disulfonic acid Openeye Name: (3E)-5-benzamido-4-oxo-3-[(1-sulfo-2-naphthyl)hydrazono]naphthalene-2,7-disulfonic acid CAS Name: (3E)-5-benzamido-4-oxo-3-[(1-sulfo-2-naphthalenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid IUPAC Name: (3E)-5-benzamido-4-oxo-3-[(1-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2,7-disulfonic acid Traditional Name: (3E)-5-benzamido-4-keto-3-[(1-sulfo-2-naphthyl)hydrazono]naphthalene-2,7-disulfonic acid Formula: C27H19N3O11S3 MolecularWeight: 657.64826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C(=NNC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)O)C3=O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N/NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)O)/C3=O)S(=O)(=O)O

InChI

InChI=1S/C27H19N3O11S3/c31-25-23-17(12-18(42(33,34)35)14-21(23)28-27(32)16-7-2-1-3-8-16)13-22(43(36,37)38)24(25)30-29-20-11-10-15-6-4-5-9-19(15)26(20)44(39,40)41/h1-14,29H,(H,28,32)(H,33,34,35)(H,36,37,38)(H,39,40,41)/b30-24-