4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-pyridin-3-yl-but-3-enyl]piperidin-4-ol

Systemtic Name: 4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-pyridin-3-yl-but-3-enyl]piperidin-4-ol Openeye Name: 4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-(3-pyridyl)but-3-enyl]piperidin-4-ol CAS Name: 4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-(3-pyridinyl)but-3-enyl]-4-piperidinol IUPAC Name: 4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-pyridin-3-ylbut-3-enyl]piperidin-4-ol Traditional Name: 4-(4-chlorophenyl)-1-[(E)-4-(2,5-dimethoxyphenyl)-4-(3-pyridyl)but-3-enyl]piperidin-4-ol Formula: C28H31ClN2O3 MolecularWeight: 479.01034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)/C(=C/CCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)/C4=CN=CC=C4

InChI

InChI=1S/C28H31ClN2O3/c1-33-24-11-12-27(34-2)26(19-24)25(21-5-3-15-30-20-21)6-4-16-31-17-13-28(32,14-18-31)22-7-9-23(29)10-8-22/h3,5-12,15,19-20,32H,4,13-14,16-18H2,1-2H3/b25-6+