ethyl (E)-2-cyano-3-[2-cyanoethyl-(phenylmethyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[2-cyanoethyl-(phenylmethyl)amino]prop-2-enoate Openeye Name: ethyl (E)-3-[benzyl(2-cyanoethyl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[2-cyanoethyl-(phenylmethyl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[benzyl(2-cyanoethyl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[benzyl(2-cyanoethyl)amino]-2-cyano-acrylic acid ethyl ester Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN(CCC#N)CC1=CC=CC=C1)C#N

Isomeric SMILES

CCOC(=O)/C(=C/N(CCC#N)CC1=CC=CC=C1)/C#N

InChI

InChI=1S/C16H17N3O2/c1-2-21-16(20)15(11-18)13-19(10-6-9-17)12-14-7-4-3-5-8-14/h3-5,7-8,13H,2,6,10,12H2,1H3/b15-13+