butanedioate; 3-(2-methylphenoxy)propane-1,2-diol

Systemtic Name: butanedioate; 3-(2-methylphenoxy)propane-1,2-diol Openeye Name: butanedioate; 3-(2-methylphenoxy)propane-1,2-diol CAS Name: butanedioate; 3-(2-methylphenoxy)propane-1,2-diol IUPAC Name: butanedioate; 3-(2-methylphenoxy)propane-1,2-diol Traditional Name: 3-(2-methylphenoxy)propane-1,2-diol; succinate Formula: C14H18O7-2 MolecularWeight: 298.28852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CO)O.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC(CO)O.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H14O3.C4H6O4/c1-8-4-2-3-5-10(8)13-7-9(12)6-11;5-3(6)1-2-4(7)8/h2-5,9,11-12H,6-7H2,1H3;1-2H2,(H,5,6)(H,7,8)/p-2