(E)-7-phenyl-2-prop-1-en-2-yl-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (E)-7-phenyl-2-prop-1-en-2-yl-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (E)-2-isopropenyl-7-phenyl-7-(3-pyridyl)hept-6-enoic acid CAS Name: (E)-2-(1-methylethenyl)-7-phenyl-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (E)-7-phenyl-2-prop-1-en-2-yl-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (E)-2-isopropenyl-7-phenyl-7-(3-pyridyl)hept-6-enoic acid Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(CCCC=C(C1=CC=CC=C1)C2=CN=CC=C2)C(=O)O

Isomeric SMILES

CC(=C)C(CCC/C=C(\C1=CC=CC=C1)/C2=CN=CC=C2)C(=O)O

InChI

InChI=1S/C21H23NO2/c1-16(2)19(21(23)24)12-6-7-13-20(17-9-4-3-5-10-17)18-11-8-14-22-15-18/h3-5,8-11,13-15,19H,1,6-7,12H2,2H3,(H,23,24)/b20-13+