methyl 2-oxidanylidene-1,5,5-triphenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 2-oxidanylidene-1,5,5-triphenyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 2-oxo-1,5,5-triphenyl-cyclohex-3-ene-1-carboxylate CAS Name: 2-oxo-1,5,5-triphenyl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 2-oxo-1,5,5-triphenylcyclohex-3-ene-1-carboxylate Traditional Name: 2-keto-1,5,5-triphenyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C26H22O3 MolecularWeight: 382.45108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C=CC1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CC(C=CC1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22O3/c1-29-24(28)26(22-15-9-4-10-16-22)19-25(18-17-23(26)27,20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-18H,19H2,1H3