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

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethyl 4-methylbenzoate Openeye Name: 2-[N-(p-tolylsulfonyl)anilino]ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-(N-(4-methylphenyl)sulfonylanilino)ethyl ester IUPAC Name: 2-(N-(4-methylphenyl)sulfonylanilino)ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-(N-tosylanilino)ethyl ester Formula: C23H23NO4S MolecularWeight: 409.49802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H23NO4S/c1-18-8-12-20(13-9-18)23(25)28-17-16-24(21-6-4-3-5-7-21)29(26,27)22-14-10-19(2)11-15-22/h3-15H,16-17H2,1-2H3