butyl 2-methylprop-2-enoate; butyl prop-2-enoate; prop-2-enenitrile

Systemtic Name: butyl 2-methylprop-2-enoate; butyl prop-2-enoate; prop-2-enenitrile Openeye Name: butyl 2-methylprop-2-enoate; butyl prop-2-enoate; prop-2-enenitrile CAS Name: 2-methyl-2-propenoic acid butyl ester; 2-propenenitrile; 2-propenoic acid butyl ester IUPAC Name: butyl 2-methylprop-2-enoate; butyl prop-2-enoate; prop-2-enenitrile Traditional Name: acrylic acid butyl ester; acrylonitrile; 2-methylacrylic acid butyl ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H14O2.C7H12O2.C3H3N/c1-4-5-6-10-8(9)7(2)3;1-3-5-6-9-7(8)4-2;1-2-3-4/h2,4-6H2,1,3H3;4H,2-3,5-6H2,1H3;2H,1H2