butyl 2-azanyl-3-(4-methylphenyl)sulfonyl-benzenecarboperoxoate

Systemtic Name: butyl 2-azanyl-3-(4-methylphenyl)sulfonyl-benzenecarboperoxoate Openeye Name: butyl 2-amino-3-(p-tolylsulfonyl)benzenecarboperoxoate CAS Name: 2-amino-3-(4-methylphenyl)sulfonylbenzenecarboperoxoic acid butyl ester IUPAC Name: butyl 2-amino-3-(4-methylphenyl)sulfonylbenzenecarboperoxoate Traditional Name: 2-amino-3-tosyl-benzenecarboperoxoic acid butyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOOC(=O)C1=C(C(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)N

Isomeric SMILES

CCCCOOC(=O)C1=C(C(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)N

InChI

InChI=1S/C18H21NO5S/c1-3-4-12-23-24-18(20)15-6-5-7-16(17(15)19)25(21,22)14-10-8-13(2)9-11-14/h5-11H,3-4,12,19H2,1-2H3