3-methyl-5-phenylmethoxy-phthalate

Systemtic Name: 3-methyl-5-phenylmethoxy-phthalate Openeye Name: 5-benzyloxy-3-methyl-phthalate CAS Name: 3-methyl-5-phenylmethoxyphthalate IUPAC Name: 3-methyl-5-phenylmethoxyphthalate Traditional Name: 5-benzoxy-3-methyl-phthalate Formula: C16H12O5-2 MolecularWeight: 284.26348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H14O5/c1-10-7-12(21-9-11-5-3-2-4-6-11)8-13(15(17)18)14(10)16(19)20/h2-8H,9H2,1H3,(H,17,18)(H,19,20)/p-2