2-methylpropyl (E)-2-cyano-3-(phenethylamino)prop-2-enoate

Systemtic Name: 2-methylpropyl (E)-2-cyano-3-(phenethylamino)prop-2-enoate Openeye Name: isobutyl (E)-2-cyano-3-(phenethylamino)prop-2-enoate CAS Name: (E)-2-cyano-3-(phenethylamino)-2-propenoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (E)-2-cyano-3-(phenethylamino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(phenethylamino)acrylic acid isobutyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(=CNCCC1=CC=CC=C1)C#N

Isomeric SMILES

CC(C)COC(=O)/C(=C/NCCC1=CC=CC=C1)/C#N

InChI

InChI=1S/C16H20N2O2/c1-13(2)12-20-16(19)15(10-17)11-18-9-8-14-6-4-3-5-7-14/h3-7,11,13,18H,8-9,12H2,1-2H3/b15-11+