2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethyl benzoate

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethyl benzoate Openeye Name: 2-[N-(p-tolylsulfonyl)anilino]ethyl benzoate CAS Name: benzoic acid 2-(N-(4-methylphenyl)sulfonylanilino)ethyl ester IUPAC Name: 2-(N-(4-methylphenyl)sulfonylanilino)ethyl benzoate Traditional Name: benzoic acid 2-(N-tosylanilino)ethyl ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCOC(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO4S/c1-18-12-14-21(15-13-18)28(25,26)23(20-10-6-3-7-11-20)16-17-27-22(24)19-8-4-2-5-9-19/h2-15H,16-17H2,1H3