(E)-2,2-dimethyl-7-phenyl-3-pyridin-3-yl-hept-6-enoate

Systemtic Name: (E)-2,2-dimethyl-7-phenyl-3-pyridin-3-yl-hept-6-enoate Openeye Name: (E)-2,2-dimethyl-7-phenyl-3-(3-pyridyl)hept-6-enoate CAS Name: (E)-2,2-dimethyl-7-phenyl-3-(3-pyridinyl)-6-heptenoate IUPAC Name: (E)-2,2-dimethyl-7-phenyl-3-pyridin-3-ylhept-6-enoate Traditional Name: (E)-2,2-dimethyl-7-phenyl-3-(3-pyridyl)hept-6-enoate Formula: C20H22NO2- MolecularWeight: 308.39418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCC=CC1=CC=CC=C1)C2=CN=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C(CC/C=C/C1=CC=CC=C1)C2=CN=CC=C2)C(=O)[O-]

InChI

InChI=1S/C20H23NO2/c1-20(2,19(22)23)18(17-12-8-14-21-15-17)13-7-6-11-16-9-4-3-5-10-16/h3-6,8-12,14-15,18H,7,13H2,1-2H3,(H,22,23)/p-1/b11-6+