3,6-diacetyloxy-6-(phenylmethyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 3,6-diacetyloxy-6-(phenylmethyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: 3,6-diacetoxy-6-benzyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: 3,6-diacetyloxy-6-(phenylmethyl)-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 3,6-diacetyloxy-6-benzylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 3,6-diacetoxy-6-benzyl-cyclohexa-2,4-diene-1-carboxylate Formula: C18H17O6- MolecularWeight: 329.32398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(C(C=C1)(CC2=CC=CC=C2)OC(=O)C)C(=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC(C(C=C1)(CC2=CC=CC=C2)OC(=O)C)C(=O)[O-]

InChI

InChI=1S/C18H18O6/c1-12(19)23-15-8-9-18(24-13(2)20,16(10-15)17(21)22)11-14-6-4-3-5-7-14/h3-10,16H,11H2,1-2H3,(H,21,22)/p-1