methyl (1R,5R)-2-oxidanylidene-1,4,5-triphenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,5R)-2-oxidanylidene-1,4,5-triphenyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,5R)-2-oxo-1,4,5-triphenyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,5R)-2-oxo-1,4,5-triphenyl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,5R)-2-oxo-1,4,5-triphenylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,5R)-2-keto-1,4,5-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)[C@]1(C[C@@H](C(=CC1=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22O3/c1-29-25(28)26(21-15-9-4-10-16-21)18-23(20-13-7-3-8-14-20)22(17-24(26)27)19-11-5-2-6-12-19/h2-17,23H,18H2,1H3/t23-,26-/m1/s1