chloranylethene; N-(hydroxymethyl)prop-2-enamide; methyl prop-2-enoate; prop-2-enoic acid

Systemtic Name: chloranylethene; N-(hydroxymethyl)prop-2-enamide; methyl prop-2-enoate; prop-2-enoic acid Openeye Name: acrylic acid; chloroethylene; N-(hydroxymethyl)prop-2-enamide; methyl prop-2-enoate CAS Name: chloroethene; N-(hydroxymethyl)-2-propenamide; 2-propenoic acid; 2-propenoic acid methyl ester IUPAC Name: chloroethene; N-(hydroxymethyl)prop-2-enamide; methyl prop-2-enoate; prop-2-enoic acid Traditional Name: acrylic acid; acrylic acid methyl ester; chloroethylene; N-methylolacrylamide Formula: C13H20ClNO6 MolecularWeight: 321.754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C.C=CC(=O)NCO.C=CC(=O)O.C=CCl

Isomeric SMILES

COC(=O)C=C.C=CC(=O)NCO.C=CC(=O)O.C=CCl

InChI

InChI=1S/C4H7NO2.C4H6O2.C3H4O2.C2H3Cl/c1-2-4(7)5-3-6;1-3-4(5)6-2;1-2-3(4)5;1-2-3/h2,6H,1,3H2,(H,5,7);3H,1H2,2H3;2H,1H2,(H,4,5);2H,1H2