3-(2-dodecylphenyl)oxirane-2-carboxylate

Systemtic Name: 3-(2-dodecylphenyl)oxirane-2-carboxylate Openeye Name: 3-(2-dodecylphenyl)oxirane-2-carboxylate CAS Name: 3-(2-dodecylphenyl)-2-oxiranecarboxylate IUPAC Name: 3-(2-dodecylphenyl)oxirane-2-carboxylate Traditional Name: 3-(2-laurylphenyl)oxirane-2-carboxylate Formula: C21H31O3- MolecularWeight: 331.46904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1C2C(O2)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1C2C(O2)C(=O)[O-]

InChI

InChI=1S/C21H32O3/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)19-20(24-19)21(22)23/h12-13,15-16,19-20H,2-11,14H2,1H3,(H,22,23)/p-1