butyl prop-2-enoate; ethyl (E)-4-cyano-2-methylidene-but-3-enoate; prop-2-enenitrile

Systemtic Name: butyl prop-2-enoate; ethyl (E)-4-cyano-2-methylidene-but-3-enoate; prop-2-enenitrile Openeye Name: butyl prop-2-enoate; ethyl (E)-4-cyano-2-methylene-but-3-enoate; prop-2-enenitrile CAS Name: (E)-4-cyano-2-methylene-3-butenoic acid ethyl ester; 2-propenenitrile; 2-propenoic acid butyl ester IUPAC Name: butyl prop-2-enoate; ethyl (E)-4-cyano-2-methylidenebut-3-enoate; prop-2-enenitrile Traditional Name: acrylic acid butyl ester; acrylonitrile; (E)-4-cyano-2-methylene-but-3-enoic acid ethyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=C.CCOC(=O)C(=C)C=CC#N.C=CC#N

Isomeric SMILES

CCCCOC(=O)C=C.CCOC(=O)C(=C)/C=C/C#N.C=CC#N

InChI

InChI=1S/C8H9NO2.C7H12O2.C3H3N/c1-3-11-8(10)7(2)5-4-6-9;1-3-5-6-9-7(8)4-2;1-2-3-4/h4-5H,2-3H2,1H3;4H,2-3,5-6H2,1H3;2H,1H2/b5-4+;;