butane-1,1-diol; prop-2-enoate; 1-prop-2-enoxyethanol

Systemtic Name: butane-1,1-diol; prop-2-enoate; 1-prop-2-enoxyethanol Openeye Name: 1-allyloxyethanol; butane-1,1-diol; prop-2-enoate CAS Name: butane-1,1-diol; 2-propenoate; 1-prop-2-enoxyethanol IUPAC Name: butane-1,1-diol; prop-2-enoate; 1-prop-2-enoxyethanol Traditional Name: acrylate; 1-allyloxyethanol; butane-1,1-diol Formula: C12H23O6- MolecularWeight: 263.30742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)O.CC(O)OCC=C.C=CC(=O)[O-]

Isomeric SMILES

CCCC(O)O.CC(O)OCC=C.C=CC(=O)[O-]

InChI

InChI=1S/C5H10O2.C4H10O2.C3H4O2/c1-3-4-7-5(2)6;1-2-3-4(5)6;1-2-3(4)5/h3,5-6H,1,4H2,2H3;4-6H,2-3H2,1H3;2H,1H2,(H,4,5)/p-1