N-(2-methyl-4-oxidanylidene-pentan-2-yl)prop-2-enamide; octadecyl 2-methylprop-2-enoate; prop-2-enenitrile

Systemtic Name: N-(2-methyl-4-oxidanylidene-pentan-2-yl)prop-2-enamide; octadecyl 2-methylprop-2-enoate; prop-2-enenitrile Openeye Name: N-(1,1-dimethyl-3-oxo-butyl)prop-2-enamide; octadecyl 2-methylprop-2-enoate; prop-2-enenitrile CAS Name: N-(2-methyl-4-oxopentan-2-yl)-2-propenamide; 2-methyl-2-propenoic acid octadecyl ester; 2-propenenitrile IUPAC Name: N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide; octadecyl 2-methylprop-2-enoate; prop-2-enenitrile Traditional Name: acrylonitrile; N-(3-keto-1,1-dimethyl-butyl)acrylamide; 2-methylacrylic acid stearyl ester Formula: C34H60N2O4 MolecularWeight: 560.8512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42O2.C9H15NO2.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;1-5-8(12)10-9(3,4)6-7(2)11;1-2-3-4/h2,4-20H2,1,3H3;5H,1,6H2,2-4H3,(H,10,12);2H,1H2