ethyl (E)-2-cyano-3-(3-methylbutanoylamino)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-(3-methylbutanoylamino)prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(3-methylbutanoylamino)prop-2-enoate CAS Name: (E)-2-cyano-3-[(3-methyl-1-oxobutyl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(3-methylbutanoylamino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(isovalerylamino)acrylic acid ethyl ester Formula: C11H16N2O3 MolecularWeight: 224.25634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(=O)CC(C)C)C#N

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O3/c1-4-16-11(15)9(6-12)7-13-10(14)5-8(2)3/h7-8H,4-5H2,1-3H3,(H,13,14)/b9-7+