phenacyl 5-methyl-2-oxidanyl-benzoate

Systemtic Name: phenacyl 5-methyl-2-oxidanyl-benzoate Openeye Name: phenacyl 2-hydroxy-5-methyl-benzoate CAS Name: 2-hydroxy-5-methylbenzoic acid phenacyl ester IUPAC Name: phenacyl 2-hydroxy-5-methylbenzoate Traditional Name: 2-hydroxy-5-methyl-benzoic acid phenacyl ester Formula: C16H14O4 MolecularWeight: 270.27996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14O4/c1-11-7-8-14(17)13(9-11)16(19)20-10-15(18)12-5-3-2-4-6-12/h2-9,17H,10H2,1H3