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

Systemtic Name: 3-[[3-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]benzoic acid CAS Name: 3-[[3-(4,5-diphenyl-2-oxazolyl)-1-cyclohex-2-enyl]methyl]benzoic acid IUPAC Name: 3-[[3-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]benzoic acid Formula: C29H25NO3 MolecularWeight: 435.5137

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=C(C1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC(=C5)C(=O)O

Isomeric SMILES

C1CC(C=C(C1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C29H25NO3/c31-29(32)25-16-8-10-21(19-25)17-20-9-7-15-24(18-20)28-30-26(22-11-3-1-4-12-22)27(33-28)23-13-5-2-6-14-23/h1-6,8,10-14,16,18-20H,7,9,15,17H2,(H,31,32)