N-[[1-[3,3-bis(3-chloranyl-4-methyl-phenyl)-3-pyridin-3-yl-propyl]-4-phenyl-piperidin-4-yl]methyl]ethanamide

Systemtic Name: N-[[1-[3,3-bis(3-chloranyl-4-methyl-phenyl)-3-pyridin-3-yl-propyl]-4-phenyl-piperidin-4-yl]methyl]ethanamide Openeye Name: N-[[1-[3,3-bis(3-chloro-4-methyl-phenyl)-3-(3-pyridyl)propyl]-4-phenyl-4-piperidyl]methyl]acetamide CAS Name: N-[[1-[3,3-bis(3-chloro-4-methylphenyl)-3-(3-pyridinyl)propyl]-4-phenyl-4-piperidinyl]methyl]acetamide IUPAC Name: N-[[1-[3,3-bis(3-chloro-4-methylphenyl)-3-pyridin-3-ylpropyl]-4-phenylpiperidin-4-yl]methyl]acetamide Traditional Name: N-[[1-[3,3-bis(3-chloro-4-methyl-phenyl)-3-(3-pyridyl)propyl]-4-phenyl-4-piperidyl]methyl]acetamide Formula: C36H39Cl2N3O MolecularWeight: 600.62036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CCN2CCC(CC2)(CNC(=O)C)C3=CC=CC=C3)(C4=CC(=C(C=C4)C)Cl)C5=CN=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(CCN2CCC(CC2)(CNC(=O)C)C3=CC=CC=C3)(C4=CC(=C(C=C4)C)Cl)C5=CN=CC=C5)Cl

InChI

InChI=1S/C36H39Cl2N3O/c1-26-11-13-30(22-33(26)37)36(32-10-7-18-39-24-32,31-14-12-27(2)34(38)23-31)17-21-41-19-15-35(16-20-41,25-40-28(3)42)29-8-5-4-6-9-29/h4-14,18,22-24H,15-17,19-21,25H2,1-3H3,(H,40,42)