[5-(3-methyloxiran-2-yl)-5-oxidanyl-cyclohexa-1,3-dien-1-yl] benzoate

Systemtic Name: [5-(3-methyloxiran-2-yl)-5-oxidanyl-cyclohexa-1,3-dien-1-yl] benzoate Openeye Name: [5-hydroxy-5-(3-methyloxiran-2-yl)cyclohexa-1,3-dien-1-yl] benzoate CAS Name: benzoic acid [5-hydroxy-5-(3-methyl-2-oxiranyl)-1-cyclohexa-1,3-dienyl] ester IUPAC Name: [5-hydroxy-5-(3-methyloxiran-2-yl)cyclohexa-1,3-dien-1-yl] benzoate Traditional Name: benzoic acid [5-hydroxy-5-(3-methyloxiran-2-yl)cyclohexa-1,3-dien-1-yl] ester Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(O1)C2(CC(=CC=C2)OC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1C(O1)C2(CC(=CC=C2)OC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C16H16O4/c1-11-14(19-11)16(18)9-5-8-13(10-16)20-15(17)12-6-3-2-4-7-12/h2-9,11,14,18H,10H2,1H3