ethyl (E)-3-[[4-[(2S)-butan-2-yl]phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[4-[(2S)-butan-2-yl]phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-[(1S)-1-methylpropyl]anilino]prop-2-enoate CAS Name: (E)-3-[4-[(2S)-butan-2-yl]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(2S)-butan-2-yl]anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-2-cyano-3-[4-[(1S)-1-methylpropyl]anilino]acrylic acid ethyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC=C(C#N)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2/c1-4-12(3)13-6-8-15(9-7-13)18-11-14(10-17)16(19)20-5-2/h6-9,11-12,18H,4-5H2,1-3H3/b14-11+/t12-/m0/s1