(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one; 1-oxidanylnaphthalene-2-sulfonic acid

Systemtic Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one; 1-oxidanylnaphthalene-2-sulfonic acid Openeye Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one; 1-hydroxynaphthalene-2-sulfonic acid CAS Name: (1E,4E)-1,5-diphenyl-3-penta-1,4-dienone; 1-hydroxy-2-naphthalenesulfonic acid IUPAC Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one; 1-hydroxynaphthalene-2-sulfonic acid Traditional Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one; 1-hydroxynaphthalene-2-sulfonic acid Formula: C27H22O5S MolecularWeight: 458.52558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.C1=CC=C2C(=C1)C=CC(=C2O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)O)O

InChI

InChI=1S/C17H14O.C10H8O4S/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16;11-10-8-4-2-1-3-7(8)5-6-9(10)15(12,13)14/h1-14H;1-6,11H,(H,12,13,14)/b13-11+,14-12+;