4-[1-[1-(5,5-dimethylcyclohexa-1,3-dien-1-yl)naphthalen-2-yl]ethyl]benzoic acid

Systemtic Name: 4-[1-[1-(5,5-dimethylcyclohexa-1,3-dien-1-yl)naphthalen-2-yl]ethyl]benzoic acid Openeye Name: 4-[1-[1-(5,5-dimethylcyclohexa-1,3-dien-1-yl)-2-naphthyl]ethyl]benzoic acid CAS Name: 4-[1-[1-(5,5-dimethyl-1-cyclohexa-1,3-dienyl)-2-naphthalenyl]ethyl]benzoic acid IUPAC Name: 4-[1-[1-(5,5-dimethylcyclohexa-1,3-dien-1-yl)naphthalen-2-yl]ethyl]benzoic acid Traditional Name: 4-[1-[1-(5,5-dimethylcyclohexa-1,3-dien-1-yl)-2-naphthyl]ethyl]benzoic acid Formula: C27H26O2 MolecularWeight: 382.49414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)O)C2=C(C3=CC=CC=C3C=C2)C4=CC=CC(C4)(C)C

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)O)C2=C(C3=CC=CC=C3C=C2)C4=CC=CC(C4)(C)C

InChI

InChI=1S/C27H26O2/c1-18(19-10-12-21(13-11-19)26(28)29)23-15-14-20-7-4-5-9-24(20)25(23)22-8-6-16-27(2,3)17-22/h4-16,18H,17H2,1-3H3,(H,28,29)