methyl 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]benzoate Openeye Name: methyl 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]benzoate CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]benzoate Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]benzoic acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C)C

InChI

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