(E)-N-[4-(1-diphenylphosphorylpiperidin-4-yl)butyl]-3-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[4-(1-diphenylphosphorylpiperidin-4-yl)butyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[4-(1-diphenylphosphoryl-4-piperidyl)butyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[4-(1-diphenylphosphoryl-4-piperidinyl)butyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[4-(1-diphenylphosphorylpiperidin-4-yl)butyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[4-(1-diphenylphosphoryl-4-piperidyl)butyl]-3-(3-pyridyl)acrylamide Formula: C29H34N3O2P MolecularWeight: 487.572921

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCCNC(=O)C=CC2=CN=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCCCNC(=O)/C=C/C2=CN=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H34N3O2P/c33-29(17-16-26-11-9-20-30-24-26)31-21-8-7-10-25-18-22-32(23-19-25)35(34,27-12-3-1-4-13-27)28-14-5-2-6-15-28/h1-6,9,11-17,20,24-25H,7-8,10,18-19,21-23H2,(H,31,33)/b17-16+