[(2-oxidanylidenecyclohexyl)-phenyl-methyl] 4-methoxybenzoate

Systemtic Name: [(2-oxidanylidenecyclohexyl)-phenyl-methyl] 4-methoxybenzoate Openeye Name: [(2-oxocyclohexyl)-phenyl-methyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2-oxocyclohexyl)-phenylmethyl] ester IUPAC Name: [(2-oxocyclohexyl)-phenylmethyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(2-ketocyclohexyl)-phenyl-methyl] ester Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC(C2CCCCC2=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC(C2CCCCC2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O4/c1-24-17-13-11-16(12-14-17)21(23)25-20(15-7-3-2-4-8-15)18-9-5-6-10-19(18)22/h2-4,7-8,11-14,18,20H,5-6,9-10H2,1H3