(6-phenoxypyridin-2-yl)methyl (E)-4-(3-chlorophenyl)-2-cyano-2-propan-2-yl-but-3-enoate

Systemtic Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(3-chlorophenyl)-2-cyano-2-propan-2-yl-but-3-enoate Openeye Name: (6-phenoxy-2-pyridyl)methyl (E)-4-(3-chlorophenyl)-2-cyano-2-isopropyl-but-3-enoate CAS Name: (E)-4-(3-chlorophenyl)-2-cyano-2-propan-2-yl-3-butenoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(3-chlorophenyl)-2-cyano-2-propan-2-ylbut-3-enoate Traditional Name: (E)-4-(3-chlorophenyl)-2-cyano-2-isopropyl-but-3-enoic acid (6-phenoxy-2-pyridyl)methyl ester Formula: C26H23ClN2O3 MolecularWeight: 446.92542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=CC1=CC(=CC=C1)Cl)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)C(/C=C/C1=CC(=CC=C1)Cl)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H23ClN2O3/c1-19(2)26(18-28,15-14-20-8-6-9-21(27)16-20)25(30)31-17-22-10-7-13-24(29-22)32-23-11-4-3-5-12-23/h3-16,19H,17H2,1-2H3/b15-14+