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

Systemtic Name: methyl 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]-5-methyl-benzoate Openeye Name: methyl 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]-5-methyl-benzoate CAS Name: 3-[[2-(4,5-diphenyl-2-oxazolyl)-1-cyclohex-2-enyl]methyl]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]-5-methylbenzoate Traditional Name: 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]-5-methyl-benzoic acid methyl ester Formula: C31H29NO3 MolecularWeight: 463.56686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OC)CC2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OC)CC2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29NO3/c1-21-17-22(20-26(18-21)31(33)34-2)19-25-15-9-10-16-27(25)30-32-28(23-11-5-3-6-12-23)29(35-30)24-13-7-4-8-14-24/h3-8,11-14,16-18,20,25H,9-10,15,19H2,1-2H3