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

Systemtic Name: 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohexyl]methyl]-2-methyl-benzoic acid Openeye Name: 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohexyl]methyl]-2-methyl-benzoic acid CAS Name: 3-[[2-(4,5-diphenyl-2-oxazolyl)cyclohexyl]methyl]-2-methylbenzoic acid IUPAC Name: 3-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohexyl]methyl]-2-methylbenzoic acid Traditional Name: 3-[[2-(4,5-diphenyloxazol-2-yl)cyclohexyl]methyl]-2-methyl-benzoic acid Formula: C30H29NO3 MolecularWeight: 451.55616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1CC2CCCCC2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1CC2CCCCC2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C30H29NO3/c1-20-23(16-10-18-25(20)30(32)33)19-24-15-8-9-17-26(24)29-31-27(21-11-4-2-5-12-21)28(34-29)22-13-6-3-7-14-22/h2-7,10-14,16,18,24,26H,8-9,15,17,19H2,1H3,(H,32,33)