deuterio 4-methylbenzenesulfonate

Systemtic Name: deuterio 4-methylbenzenesulfonate Openeye Name: deuterio 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid deuterio ester IUPAC Name: deuterio 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid deuterio ester Formula: C7H8O3S MolecularWeight: 173.207782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

[2H]OS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C7H8O3S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H,8,9,10)/i/hD