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

Systemtic Name: pyridin-3-yl (E)-2,2-dimethyl-7-phenyl-hept-6-enoate Openeye Name: 3-pyridyl (E)-2,2-dimethyl-7-phenyl-hept-6-enoate CAS Name: (E)-2,2-dimethyl-7-phenyl-6-heptenoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl (E)-2,2-dimethyl-7-phenylhept-6-enoate Traditional Name: (E)-2,2-dimethyl-7-phenyl-hept-6-enoic acid 3-pyridyl ester Formula: C20H23NO2 MolecularWeight: 309.40212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC=CC1=CC=CC=C1)C(=O)OC2=CN=CC=C2

Isomeric SMILES

CC(C)(CCC/C=C/C1=CC=CC=C1)C(=O)OC2=CN=CC=C2

InChI

InChI=1S/C20H23NO2/c1-20(2,19(22)23-18-13-9-15-21-16-18)14-8-4-7-12-17-10-5-3-6-11-17/h3,5-7,9-13,15-16H,4,8,14H2,1-2H3/b12-7+