buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile

Systemtic Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile Openeye Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile CAS Name: buta-1,3-diene; 2-methyl-2-propenoic acid methyl ester; 2-propenenitrile IUPAC Name: buta-1,3-diene; methyl 2-methylprop-2-enoate; prop-2-enenitrile Traditional Name: acrylonitrile; buta-1,3-diene; 2-methylacrylic acid methyl ester Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8O2.C4H6.C3H3N/c1-4(2)5(6)7-3;1-3-4-2;1-2-3-4/h1H2,2-3H3;3-4H,1-2H2;2H,1H2