ethyl 4-[(2-methylphenyl)methyl-methylsulfonyl-amino]benzoate

Systemtic Name: ethyl 4-[(2-methylphenyl)methyl-methylsulfonyl-amino]benzoate Openeye Name: ethyl 4-[methylsulfonyl(o-tolylmethyl)amino]benzoate CAS Name: 4-[(2-methylphenyl)methyl-methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methylphenyl)methyl-methylsulfonylamino]benzoate Traditional Name: 4-[mesyl-(2-methylbenzyl)amino]benzoic acid ethyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2C)S(=O)(=O)C

InChI

InChI=1S/C18H21NO4S/c1-4-23-18(20)15-9-11-17(12-10-15)19(24(3,21)22)13-16-8-6-5-7-14(16)2/h5-12H,4,13H2,1-3H3