4-[1-[8-(5-methoxypyridin-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid

Systemtic Name: 4-[1-[8-(5-methoxypyridin-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Openeye Name: 4-[1-[8-(5-methoxy-2-pyridyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid CAS Name: 4-[1-[8-(5-methoxy-2-pyridinyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid IUPAC Name: 4-[1-[8-(5-methoxypyridin-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Traditional Name: 4-[1-[8-(5-methoxy-2-pyridyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=NC=C(C=C4)OC)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=NC=C(C=C4)OC)C

InChI

InChI=1S/C27H25NO3/c1-17(18-5-7-19(8-6-18)26(29)30)20-9-11-24-23(15-20)22(13-14-27(24,2)3)25-12-10-21(31-4)16-28-25/h5-13,15-16H,1,14H2,2-4H3,(H,29,30)