methyl (Z)-6-[(2S,4S,5R)-2-[1-(2-cyanophenyl)-2-methyl-propan-2-yl]-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoate

Systemtic Name: methyl (Z)-6-[(2S,4S,5R)-2-[1-(2-cyanophenyl)-2-methyl-propan-2-yl]-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoate Openeye Name: methyl (Z)-6-[(2S,4S,5R)-2-[2-(2-cyanophenyl)-1,1-dimethyl-ethyl]-4-(3-pyridyl)-1,3-dioxan-5-yl]hex-4-enoate CAS Name: (Z)-6-[(2S,4S,5R)-2-[1-(2-cyanophenyl)-2-methylpropan-2-yl]-4-(3-pyridinyl)-1,3-dioxan-5-yl]-4-hexenoic acid methyl ester IUPAC Name: methyl (Z)-6-[(2S,4S,5R)-2-[1-(2-cyanophenyl)-2-methylpropan-2-yl]-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoate Traditional Name: (Z)-6-[(2S,4S,5R)-2-[2-(2-cyanophenyl)-1,1-dimethyl-ethyl]-4-(3-pyridyl)-1,3-dioxan-5-yl]hex-4-enoic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1C#N)C2OCC(C(O2)C3=CN=CC=C3)CC=CCCC(=O)OC

Isomeric SMILES

CC(C)(CC1=CC=CC=C1C#N)[C@H]2OC[C@H]([C@H](O2)C3=CN=CC=C3)C/C=C\CCC(=O)OC

InChI

InChI=1S/C27H32N2O4/c1-27(2,16-20-10-7-8-11-21(20)17-28)26-32-19-23(12-5-4-6-14-24(30)31-3)25(33-26)22-13-9-15-29-18-22/h4-5,7-11,13,15,18,23,25-26H,6,12,14,16,19H2,1-3H3/b5-4-/t23-,25-,26+/m1/s1