3-ethanoyl-2-oxidanylidene-3-(phenylmethyl)pent-4-enoic acid

Systemtic Name: 3-ethanoyl-2-oxidanylidene-3-(phenylmethyl)pent-4-enoic acid Openeye Name: 3-acetyl-3-benzyl-2-oxo-pent-4-enoic acid CAS Name: 3-acetyl-2-oxo-3-(phenylmethyl)-4-pentenoic acid IUPAC Name: 3-acetyl-3-benzyl-2-oxopent-4-enoic acid Traditional Name: 3-acetyl-3-benzyl-2-keto-pent-4-enoic acid Formula: C14H14O4 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)(C=C)C(=O)C(=O)O

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)(C=C)C(=O)C(=O)O

InChI

InChI=1S/C14H14O4/c1-3-14(10(2)15,12(16)13(17)18)9-11-7-5-4-6-8-11/h3-8H,1,9H2,2H3,(H,17,18)