(2-hydroxyphenyl)-bis[(E)-2-phenylethenyl]azanium sulfate

Systemtic Name: (2-hydroxyphenyl)-bis[(E)-2-phenylethenyl]azanium sulfate Openeye Name: (2-hydroxyphenyl)-bis[(E)-styryl]ammonium sulfate CAS Name: (2-hydroxyphenyl)-bis[(E)-2-phenylethenyl]ammonium sulfate IUPAC Name: (2-hydroxyphenyl)-bis[(E)-2-phenylethenyl]azanium sulfate Traditional Name: (2-hydroxyphenyl)-bis[(E)-styryl]ammonium sulfate Formula: C44H40N2O6S MolecularWeight: 724.8632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C[NH+](C=CC2=CC=CC=C2)C3=CC=CC=C3O.C1=CC=C(C=C1)C=C[NH+](C=CC2=CC=CC=C2)C3=CC=CC=C3O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/[NH+](C2=CC=CC=C2O)/C=C/C3=CC=CC=C3.C1=CC=C(C=C1)/C=C/[NH+](C2=CC=CC=C2O)/C=C/C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C22H19NO.H2O4S/c2*24-22-14-8-7-13-21(22)23(17-15-19-9-3-1-4-10-19)18-16-20-11-5-2-6-12-20;1-5(2,3)4/h2*1-18,24H;(H2,1,2,3,4)/b2*17-15+,18-16+;