butyl 2-methylprop-2-enoate; dodecane-1-thiol; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate

Systemtic Name: butyl 2-methylprop-2-enoate; dodecane-1-thiol; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate Openeye Name: butyl 2-methylprop-2-enoate; dodecane-1-thiol; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate CAS Name: 1-dodecanethiol; 2-methyl-2-propenoic acid butyl ester; 2-methyl-2-propenoic acid 1-isocyanatoethyl ester; 2-methyl-2-propenoic acid methyl ester IUPAC Name: butyl 2-methylprop-2-enoate; dodecane-1-thiol; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate Traditional Name: dodecane-1-thiol; 2-methylacrylic acid butyl ester; 2-methylacrylic acid 1-isocyanatoethyl ester; 2-methylacrylic acid methyl ester Formula: C32H57NO7S MolecularWeight: 599.86248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS.CCCCOC(=O)C(=C)C.CC(N=C=O)OC(=O)C(=C)C.CC(=C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCS.CCCCOC(=O)C(=C)C.CC(N=C=O)OC(=O)C(=C)C.CC(=C)C(=O)OC

InChI

InChI=1S/C12H26S.C8H14O2.C7H9NO3.C5H8O2/c1-2-3-4-5-6-7-8-9-10-11-12-13;1-4-5-6-10-8(9)7(2)3;1-5(2)7(10)11-6(3)8-4-9;1-4(2)5(6)7-3/h13H,2-12H2,1H3;2,4-6H2,1,3H3;6H,1H2,2-3H3;1H2,2-3H3