2,2-bis(hydroxymethyl)propane-1,3-diol; 2-ethenylphenol; 2-methylprop-2-enoate

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-ethenylphenol; 2-methylprop-2-enoate Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylprop-2-enoate; 2-vinylphenol CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-ethenylphenol; 2-methyl-2-propenoate IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-ethenylphenol; 2-methylprop-2-enoate Traditional Name: 2,2-dimethylolpropane-1,3-diol; methacrylate; 2-vinylphenol Formula: C46H63O17-3 MolecularWeight: 887.98222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].C=CC1=CC=CC=C1O.C=CC1=CC=CC=C1O.C=CC1=CC=CC=C1O.C(C(CO)(CO)CO)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].C=CC1=CC=CC=C1O.C=CC1=CC=CC=C1O.C=CC1=CC=CC=C1O.C(C(CO)(CO)CO)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/3C8H8O.2C5H12O4.3C4H6O2/c3*1-2-7-5-3-4-6-8(7)9;2*6-1-5(2-7,3-8)4-9;3*1-3(2)4(5)6/h3*2-6,9H,1H2;2*6-9H,1-4H2;3*1H2,2H3,(H,5,6)/p-3