(E)-4-[(2-cyanophenyl)methoxy]-3-(3-hydroxyphenyl)-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[(2-cyanophenyl)methoxy]-3-(3-hydroxyphenyl)-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[(2-cyanophenyl)methoxy]-4-hydroxy-3-(3-hydroxyphenyl)-2-oxo-but-3-enoic acid CAS Name: (E)-4-[(2-cyanophenyl)methoxy]-4-hydroxy-3-(3-hydroxyphenyl)-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[(2-cyanophenyl)methoxy]-4-hydroxy-3-(3-hydroxyphenyl)-2-oxobut-3-enoic acid Traditional Name: (E)-4-(2-cyanobenzyl)oxy-4-hydroxy-3-(3-hydroxyphenyl)-2-keto-but-3-enoic acid Formula: C18H13NO6 MolecularWeight: 339.29892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=C(C2=CC(=CC=C2)O)C(=O)C(=O)O)O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CO/C(=C(\C2=CC(=CC=C2)O)/C(=O)C(=O)O)/O)C#N

InChI

InChI=1S/C18H13NO6/c19-9-12-4-1-2-5-13(12)10-25-18(24)15(16(21)17(22)23)11-6-3-7-14(20)8-11/h1-8,20,24H,10H2,(H,22,23)/b18-15+