ethanenitrile; 2-methylprop-2-enoic acid; propan-2-one; prop-2-enoic acid

Systemtic Name: ethanenitrile; 2-methylprop-2-enoic acid; propan-2-one; prop-2-enoic acid Openeye Name: acetone; acetonitrile; acrylic acid; 2-methylprop-2-enoic acid CAS Name: acetonitrile; 2-methyl-2-propenoic acid; 2-propanone; 2-propenoic acid IUPAC Name: acetonitrile; 2-methylprop-2-enoic acid; propan-2-one; prop-2-enoic acid Traditional Name: acetone; acetonitrile; acrylic acid; methacrylic acid Formula: C15H25NO6 MolecularWeight: 315.3621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6O2.C3H4O2.2C3H6O.C2H3N/c1-3(2)4(5)6;1-2-3(4)5;2*1-3(2)4;1-2-3/h1H2,2H3,(H,5,6);2H,1H2,(H,4,5);2*1-2H3;1H3