(E)-4-[3-[(3-chlorophenyl)methoxy]phenyl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[3-[(3-chlorophenyl)methoxy]phenyl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[3-[(3-chlorophenyl)methoxy]phenyl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[3-[(3-chlorophenyl)methoxy]phenyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[3-[(3-chlorophenyl)methoxy]phenyl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[3-(3-chlorobenzyl)oxyphenyl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C17H13ClO5 MolecularWeight: 332.73512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)COC2=CC=CC(=C2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)COC2=CC=CC(=C2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C17H13ClO5/c18-13-5-1-3-11(7-13)10-23-14-6-2-4-12(8-14)15(19)9-16(20)17(21)22/h1-9,19H,10H2,(H,21,22)/b15-9+