4-[3-[3-tert-butyl-5-(4-methylphenyl)-4-phenylmethoxy-phenyl]-3-oxidanyl-prop-1-ynyl]benzoic acid

Systemtic Name: 4-[3-[3-tert-butyl-5-(4-methylphenyl)-4-phenylmethoxy-phenyl]-3-oxidanyl-prop-1-ynyl]benzoic acid Openeye Name: 4-[3-[4-benzyloxy-3-tert-butyl-5-(p-tolyl)phenyl]-3-hydroxy-prop-1-ynyl]benzoic acid CAS Name: 4-[3-[3-tert-butyl-5-(4-methylphenyl)-4-phenylmethoxyphenyl]-3-hydroxyprop-1-ynyl]benzoic acid IUPAC Name: 4-[3-[3-tert-butyl-5-(4-methylphenyl)-4-phenylmethoxyphenyl]-3-hydroxyprop-1-ynyl]benzoic acid Traditional Name: 4-[3-[4-benzoxy-3-tert-butyl-5-(p-tolyl)phenyl]-3-hydroxy-prop-1-ynyl]benzoic acid Formula: C34H32O4 MolecularWeight: 504.61548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC(=C2OCC3=CC=CC=C3)C(C)(C)C)C(C#CC4=CC=C(C=C4)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC(=C2OCC3=CC=CC=C3)C(C)(C)C)C(C#CC4=CC=C(C=C4)C(=O)O)O

InChI

InChI=1S/C34H32O4/c1-23-10-15-26(16-11-23)29-20-28(31(35)19-14-24-12-17-27(18-13-24)33(36)37)21-30(34(2,3)4)32(29)38-22-25-8-6-5-7-9-25/h5-13,15-18,20-21,31,35H,22H2,1-4H3,(H,36,37)