methyl (E)-2-cyano-3-[[1-(phenylmethyl)piperidin-4-yl]amino]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[[1-(phenylmethyl)piperidin-4-yl]amino]prop-2-enoate Openeye Name: methyl (E)-3-[(1-benzyl-4-piperidyl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[[1-(phenylmethyl)-4-piperidinyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(1-benzylpiperidin-4-yl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[(1-benzyl-4-piperidyl)amino]-2-cyano-acrylic acid methyl ester Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CNC1CCN(CC1)CC2=CC=CC=C2)C#N

Isomeric SMILES

COC(=O)/C(=C/NC1CCN(CC1)CC2=CC=CC=C2)/C#N

InChI

InChI=1S/C17H21N3O2/c1-22-17(21)15(11-18)12-19-16-7-9-20(10-8-16)13-14-5-3-2-4-6-14/h2-6,12,16,19H,7-10,13H2,1H3/b15-12+