methyl 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohexyl]methyl]-4-methyl-benzoate

Systemtic Name: methyl 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohexyl]methyl]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohexyl]methyl]-4-methyl-benzoate CAS Name: 3-[[2-(4,5-diphenyl-2-oxazolyl)cyclohexyl]methyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohexyl]methyl]-4-methylbenzoate Traditional Name: 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohexyl]methyl]-4-methyl-benzoic acid methyl ester Formula: C31H31NO3 MolecularWeight: 465.58274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)CC2CCCCC2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)CC2CCCCC2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31NO3/c1-21-17-18-25(31(33)34-2)20-26(21)19-24-15-9-10-16-27(24)30-32-28(22-11-5-3-6-12-22)29(35-30)23-13-7-4-8-14-23/h3-8,11-14,17-18,20,24,27H,9-10,15-16,19H2,1-2H3