2-ethynyl-5,5-dimethyl-3-[8-(4-methylphenyl)naphthalen-2-yl]cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 2-ethynyl-5,5-dimethyl-3-[8-(4-methylphenyl)naphthalen-2-yl]cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 2-ethynyl-5,5-dimethyl-3-[8-(p-tolyl)-2-naphthyl]cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 2-ethynyl-5,5-dimethyl-3-[8-(4-methylphenyl)-2-naphthalenyl]-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 2-ethynyl-5,5-dimethyl-3-[8-(4-methylphenyl)naphthalen-2-yl]cyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 2-ethynyl-5,5-dimethyl-3-[8-(p-tolyl)-2-naphthyl]cyclohexa-1,3-diene-1-carboxylic acid Formula: C28H24O2 MolecularWeight: 392.48896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C2C=C(C=C3)C4=CC(CC(=C4C#C)C(=O)O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C2C=C(C=C3)C4=CC(CC(=C4C#C)C(=O)O)(C)C

InChI

InChI=1S/C28H24O2/c1-5-22-25(16-28(3,4)17-26(22)27(29)30)21-14-13-19-7-6-8-23(24(19)15-21)20-11-9-18(2)10-12-20/h1,6-16H,17H2,2-4H3,(H,29,30)