3-(4-cyclopropyl-2-phenoxy-phenyl)-2,2-dimethyl-1-(2-methylpyridin-3-yl)cyclopropane-1-carboxylate

Systemtic Name: 3-(4-cyclopropyl-2-phenoxy-phenyl)-2,2-dimethyl-1-(2-methylpyridin-3-yl)cyclopropane-1-carboxylate Openeye Name: 3-(4-cyclopropyl-2-phenoxy-phenyl)-2,2-dimethyl-1-(2-methyl-3-pyridyl)cyclopropanecarboxylate CAS Name: 3-(4-cyclopropyl-2-phenoxyphenyl)-2,2-dimethyl-1-(2-methyl-3-pyridinyl)-1-cyclopropanecarboxylate IUPAC Name: 3-(4-cyclopropyl-2-phenoxyphenyl)-2,2-dimethyl-1-(2-methylpyridin-3-yl)cyclopropane-1-carboxylate Traditional Name: 3-(4-cyclopropyl-2-phenoxy-phenyl)-2,2-dimethyl-1-(2-methyl-3-pyridyl)cyclopropanecarboxylate Formula: C27H26NO3- MolecularWeight: 412.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C2(C(C2(C)C)C3=C(C=C(C=C3)C4CC4)OC5=CC=CC=C5)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=N1)C2(C(C2(C)C)C3=C(C=C(C=C3)C4CC4)OC5=CC=CC=C5)C(=O)[O-]

InChI

InChI=1S/C27H27NO3/c1-17-22(10-7-15-28-17)27(25(29)30)24(26(27,2)3)21-14-13-19(18-11-12-18)16-23(21)31-20-8-5-4-6-9-20/h4-10,13-16,18,24H,11-12H2,1-3H3,(H,29,30)/p-1