ethyl (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]but-2-enoate

Systemtic Name: ethyl (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]but-2-enoate Openeye Name: ethyl (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]but-2-enoate CAS Name: (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]but-2-enoate Traditional Name: (Z)-2-(cyanomethyl)-3-[[(1R)-1-phenylethyl]amino]but-2-enoic acid ethyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)NC(C)C1=CC=CC=C1)CC#N

Isomeric SMILES

CCOC(=O)/C(=C(/C)\N[C@H](C)C1=CC=CC=C1)/CC#N

InChI

InChI=1S/C16H20N2O2/c1-4-20-16(19)15(10-11-17)13(3)18-12(2)14-8-6-5-7-9-14/h5-9,12,18H,4,10H2,1-3H3/b15-13-/t12-/m1/s1