butyl prop-2-enoate; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate

Systemtic Name: butyl prop-2-enoate; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate Openeye Name: butyl prop-2-enoate; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 1-isocyanatoethyl ester; 2-methyl-2-propenoic acid methyl ester; 2-propenoic acid butyl ester IUPAC Name: butyl prop-2-enoate; 1-isocyanatoethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate Traditional Name: acrylic acid butyl ester; 2-methylacrylic acid 1-isocyanatoethyl ester; 2-methylacrylic acid methyl ester Formula: C19H29NO7 MolecularWeight: 383.43606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9NO3.C7H12O2.C5H8O2/c1-5(2)7(10)11-6(3)8-4-9;1-3-5-6-9-7(8)4-2;1-4(2)5(6)7-3/h6H,1H2,2-3H3;4H,2-3,5-6H2,1H3;1H2,2-3H3