(2E)-2-[[4-[4-(diphenylmethyl)piperazin-1-yl]pyridin-3-yl]methylidene]-5-oxidanyl-hexanamide

Systemtic Name: (2E)-2-[[4-[4-(diphenylmethyl)piperazin-1-yl]pyridin-3-yl]methylidene]-5-oxidanyl-hexanamide Openeye Name: (2E)-2-[[4-(4-benzhydrylpiperazin-1-yl)-3-pyridyl]methylene]-5-hydroxy-hexanamide CAS Name: (2E)-2-[[4-[4-(diphenylmethyl)-1-piperazinyl]-3-pyridinyl]methylidene]-5-hydroxyhexanamide IUPAC Name: (2E)-2-[[4-(4-benzhydrylpiperazin-1-yl)pyridin-3-yl]methylidene]-5-hydroxyhexanamide Traditional Name: (E)-3-[4-(4-benzhydrylpiperazino)-3-pyridyl]-2-(3-hydroxybutyl)acrylamide Formula: C29H34N4O2 MolecularWeight: 470.60586

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=CC1=C(C=CN=C1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N)O

Isomeric SMILES

CC(CC/C(=C\C1=C(C=CN=C1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)N)O

InChI

InChI=1S/C29H34N4O2/c1-22(34)12-13-25(29(30)35)20-26-21-31-15-14-27(26)32-16-18-33(19-17-32)28(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-11,14-15,20-22,28,34H,12-13,16-19H2,1H3,(H2,30,35)/b25-20+