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

Systemtic Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(2-tert-butylphenyl)-2-cyano-2-propan-2-yl-but-3-enoate Openeye Name: (6-phenoxy-2-pyridyl)methyl (E)-4-(2-tert-butylphenyl)-2-cyano-2-isopropyl-but-3-enoate CAS Name: (E)-4-(2-tert-butylphenyl)-2-cyano-2-propan-2-yl-3-butenoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(2-tert-butylphenyl)-2-cyano-2-propan-2-ylbut-3-enoate Traditional Name: (E)-4-(2-tert-butylphenyl)-2-cyano-2-isopropyl-but-3-enoic acid (6-phenoxy-2-pyridyl)methyl ester Formula: C30H32N2O3 MolecularWeight: 468.58668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=CC1=CC=CC=C1C(C)(C)C)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)C(/C=C/C1=CC=CC=C1C(C)(C)C)(C#N)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C30H32N2O3/c1-22(2)30(21-31,19-18-23-12-9-10-16-26(23)29(3,4)5)28(33)34-20-24-13-11-17-27(32-24)35-25-14-7-6-8-15-25/h6-19,22H,20H2,1-5H3/b19-18+