(3E)-3-[[4-methoxy-3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-3-[[4-methoxy-3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3E)-3-[[4-methoxy-3-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3E)-3-[[4-methoxy-3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3E)-3-[[4-methoxy-3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3E)-4-keto-3-[[4-methoxy-3-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]naphthalene-2,7-disulfonic acid Formula: C19H18N2O14S4 MolecularWeight: 626.61122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C19H18N2O14S4/c1-34-15-5-2-12(10-16(15)36(23,24)7-6-35-39(31,32)33)20-21-18-17(38(28,29)30)9-11-8-13(37(25,26)27)3-4-14(11)19(18)22/h2-5,8-10,20H,6-7H2,1H3,(H,25,26,27)(H,28,29,30)(H,31,32,33)/b21-18-