phenoxybenzene; propane-1,2-diol; propanoate

Systemtic Name: phenoxybenzene; propane-1,2-diol; propanoate Openeye Name: phenoxybenzene; propane-1,2-diol; propanoate CAS Name: phenoxybenzene; propane-1,2-diol; propanoate IUPAC Name: phenoxybenzene; propane-1,2-diol; propanoate Traditional Name: phenoxybenzene; propane-1,2-diol; propionate Formula: C18H23O5- MolecularWeight: 319.37222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[O-].CC(CO)O.C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCC(=O)[O-].CC(CO)O.C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C12H10O.C3H8O2.C3H6O2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3(5)2-4;1-2-3(4)5/h1-10H;3-5H,2H2,1H3;2H2,1H3,(H,4,5)/p-1