(E)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-enoic acid Openeye Name: (E)-3-(1-benzyl-4-piperidyl)prop-2-enoic acid CAS Name: (E)-3-[1-(phenylmethyl)-4-piperidinyl]-2-propenoic acid IUPAC Name: (E)-3-(1-benzylpiperidin-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-benzyl-4-piperidyl)acrylic acid Formula: C15H19NO2 MolecularWeight: 245.31686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C=CC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1/C=C/C(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C15H19NO2/c17-15(18)7-6-13-8-10-16(11-9-13)12-14-4-2-1-3-5-14/h1-7,13H,8-12H2,(H,17,18)/b7-6+