1-(4-chlorophenyl)ethanone; (E)-3-(4-ethanoylphenyl)prop-2-enoic acid

Systemtic Name: 1-(4-chlorophenyl)ethanone; (E)-3-(4-ethanoylphenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-acetylphenyl)prop-2-enoic acid; 1-(4-chlorophenyl)ethanone CAS Name: (E)-3-(4-acetylphenyl)-2-propenoic acid; 1-(4-chlorophenyl)ethanone IUPAC Name: (E)-3-(4-acetylphenyl)prop-2-enoic acid; 1-(4-chlorophenyl)ethanone Traditional Name: (E)-3-(4-acetylphenyl)acrylic acid; 1-(4-chlorophenyl)ethanone Formula: C19H17ClO4 MolecularWeight: 344.78888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C=CC(=O)O.CC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)/C=C/C(=O)O.CC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C11H10O3.C8H7ClO/c1-8(12)10-5-2-9(3-6-10)4-7-11(13)14;1-6(10)7-2-4-8(9)5-3-7/h2-7H,1H3,(H,13,14);2-5H,1H3/b7-4+;