octadecyl 2-methylprop-2-enoate; prop-2-enenitrile

Systemtic Name: octadecyl 2-methylprop-2-enoate; prop-2-enenitrile Openeye Name: octadecyl 2-methylprop-2-enoate; prop-2-enenitrile CAS Name: 2-methyl-2-propenoic acid octadecyl ester; 2-propenenitrile IUPAC Name: octadecyl 2-methylprop-2-enoate; prop-2-enenitrile Traditional Name: acrylonitrile; 2-methylacrylic acid stearyl ester Formula: C25H45NO2 MolecularWeight: 391.6303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42O2.C3H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-22(23)21(2)3;1-2-3-4/h2,4-20H2,1,3H3;2H,1H2