butane; methanal; octadecyl 2-methylprop-2-enoate

Systemtic Name: butane; methanal; octadecyl 2-methylprop-2-enoate Openeye Name: butane; formaldehyde; octadecyl 2-methylprop-2-enoate CAS Name: butane; formaldehyde; 2-methyl-2-propenoic acid octadecyl ester IUPAC Name: butane; formaldehyde; octadecyl 2-methylprop-2-enoate Traditional Name: formaldehyde; 2-methylacrylic acid stearyl ester; n-butane Formula: C27H54O3 MolecularWeight: 426.71586

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=O

Isomeric SMILES

CCCC.CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=O

InChI

InChI=1S/C22H42O2.C4H10.CH2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-22(23)21(2)3;1-3-4-2;1-2/h2,4-20H2,1,3H3;3-4H2,1-2H3;1H2