(3E)-5-acetamido-3-[[4-(2-azanylethyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-5-acetamido-3-[[4-(2-azanylethyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3E)-5-acetamido-3-[[4-(2-aminoethyl)phenyl]hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3E)-5-acetamido-3-[[4-(2-aminoethyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3E)-5-acetamido-3-[[4-(2-aminoethyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3E)-5-acetamido-3-[[4-(2-aminoethyl)phenyl]hydrazono]-4-keto-naphthalene-2,7-disulfonic acid Formula: C20H20N4O8S2 MolecularWeight: 508.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=NNC3=CC=C(C=C3)CCN)C2=O)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC=C(C=C3)CCN)/C2=O)S(=O)(=O)O

InChI

InChI=1S/C20H20N4O8S2/c1-11(25)22-16-10-15(33(27,28)29)8-13-9-17(34(30,31)32)19(20(26)18(13)16)24-23-14-4-2-12(3-5-14)6-7-21/h2-5,8-10,23H,6-7,21H2,1H3,(H,22,25)(H,27,28,29)(H,30,31,32)/b24-19-