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

Systemtic Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(4-methylphenyl)-2-propan-2-yl-but-3-enoate Openeye Name: (6-phenoxy-2-pyridyl)methyl (E)-2-isopropyl-4-(p-tolyl)but-3-enoate CAS Name: (E)-4-(4-methylphenyl)-2-propan-2-yl-3-butenoic acid (6-phenoxy-2-pyridinyl)methyl ester IUPAC Name: (6-phenoxypyridin-2-yl)methyl (E)-4-(4-methylphenyl)-2-propan-2-ylbut-3-enoate Traditional Name: (E)-2-isopropyl-4-(p-tolyl)but-3-enoic acid (6-phenoxy-2-pyridyl)methyl ester Formula: C26H27NO3 MolecularWeight: 401.49748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(C(C)C)C(=O)OCC2=NC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H27NO3/c1-19(2)24(17-16-21-14-12-20(3)13-15-21)26(28)29-18-22-8-7-11-25(27-22)30-23-9-5-4-6-10-23/h4-17,19,24H,18H2,1-3H3/b17-16+