4-[1-[5,5-dimethyl-8-(6-methylpyridin-3-yl)-6H-naphthalen-2-yl]ethyl]benzoic acid

Systemtic Name: 4-[1-[5,5-dimethyl-8-(6-methylpyridin-3-yl)-6H-naphthalen-2-yl]ethyl]benzoic acid Openeye Name: 4-[1-[5,5-dimethyl-8-(6-methyl-3-pyridyl)-6H-naphthalen-2-yl]ethyl]benzoic acid CAS Name: 4-[1-[5,5-dimethyl-8-(6-methyl-3-pyridinyl)-6H-naphthalen-2-yl]ethyl]benzoic acid IUPAC Name: 4-[1-[5,5-dimethyl-8-(6-methylpyridin-3-yl)-6H-naphthalen-2-yl]ethyl]benzoic acid Traditional Name: 4-[1-[5,5-dimethyl-8-(6-methyl-3-pyridyl)-6H-naphthalen-2-yl]ethyl]benzoic acid Formula: C27H27NO2 MolecularWeight: 397.50878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27NO2/c1-17-5-6-22(16-28-17)23-13-14-27(3,4)25-12-11-21(15-24(23)25)18(2)19-7-9-20(10-8-19)26(29)30/h5-13,15-16,18H,14H2,1-4H3,(H,29,30)