4-[3-[8,8-dimethyl-5-(4-methylphenyl)-7H-naphthalen-2-yl]-3-oxidanyl-prop-1-ynyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-[8,8-dimethyl-5-(4-methylphenyl)-7H-naphthalen-2-yl]-3-oxidanyl-prop-1-ynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-[8,8-dimethyl-5-(p-tolyl)-7H-naphthalen-2-yl]-3-hydroxy-prop-1-ynyl]-2-hydroxy-benzoic acid CAS Name: 4-[3-[8,8-dimethyl-5-(4-methylphenyl)-7H-naphthalen-2-yl]-3-hydroxyprop-1-ynyl]-2-hydroxybenzoic acid IUPAC Name: 4-[3-[8,8-dimethyl-5-(4-methylphenyl)-7H-naphthalen-2-yl]-3-hydroxyprop-1-ynyl]-2-hydroxybenzoic acid Traditional Name: 4-[3-[8,8-dimethyl-5-(p-tolyl)-7H-naphthalen-2-yl]-3-hydroxy-prop-1-ynyl]-2-hydroxy-benzoic acid Formula: C29H26O4 MolecularWeight: 438.51434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CCC(C3=C2C=CC(=C3)C(C#CC4=CC(=C(C=C4)C(=O)O)O)O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CCC(C3=C2C=CC(=C3)C(C#CC4=CC(=C(C=C4)C(=O)O)O)O)(C)C

InChI

InChI=1S/C29H26O4/c1-18-4-8-20(9-5-18)22-14-15-29(2,3)25-17-21(10-12-23(22)25)26(30)13-7-19-6-11-24(28(32)33)27(31)16-19/h4-6,8-12,14,16-17,26,30-31H,15H2,1-3H3,(H,32,33)