(6E)-3-azanyl-6-[[2-methoxy-4-[(5-sulfonaphthalen-2-yl)diazenyl]phenyl]hydrazinylidene]-5-oxidanylidene-7-sulfinooxy-naphthalene-2-sulfonic acid

Systemtic Name: (6E)-3-azanyl-6-[[2-methoxy-4-[(5-sulfonaphthalen-2-yl)diazenyl]phenyl]hydrazinylidene]-5-oxidanylidene-7-sulfinooxy-naphthalene-2-sulfonic acid Openeye Name: (6E)-3-amino-6-[[2-methoxy-4-[(5-sulfo-2-naphthyl)azo]phenyl]hydrazono]-5-oxo-7-sulfinooxy-naphthalene-2-sulfonic acid CAS Name: (6E)-3-amino-6-[[2-methoxy-4-[(5-sulfo-2-naphthalenyl)azo]phenyl]hydrazinylidene]-5-oxo-7-sulfinooxy-2-naphthalenesulfonic acid IUPAC Name: (6E)-3-amino-6-[[2-methoxy-4-[(5-sulfonaphthalen-2-yl)diazenyl]phenyl]hydrazinylidene]-5-oxo-7-sulfinooxynaphthalene-2-sulfonic acid Traditional Name: (6E)-3-amino-5-keto-6-[[2-methoxy-4-[(5-sulfo-2-naphthyl)azo]phenyl]hydrazono]-7-sulfinooxy-naphthalene-2-sulfonic acid Formula: C27H21N5O11S3 MolecularWeight: 687.67754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C2)C(=CC=C3)S(=O)(=O)O)NN=C4C(=CC5=CC(=C(C=C5C4=O)N)S(=O)(=O)O)OS(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C2)C(=CC=C3)S(=O)(=O)O)N/N=C/4\C(=CC5=CC(=C(C=C5C4=O)N)S(=O)(=O)O)OS(=O)O

InChI

InChI=1S/C27H21N5O11S3/c1-42-22-12-17(30-29-16-5-7-18-14(9-16)3-2-4-24(18)45(36,37)38)6-8-21(22)31-32-26-23(43-44(34)35)10-15-11-25(46(39,40)41)20(28)13-19(15)27(26)33/h2-13,31H,28H2,1H3,(H,34,35)(H,36,37,38)(H,39,40,41)/b30-29?,32-26+