ethyl 2-methyl-3-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 2-methyl-3-[[2-(N-methylsulfonyl-4-propoxy-anilino)acetyl]amino]benzoate CAS Name: 2-methyl-3-[[2-(N-methylsulfonyl-4-propoxyanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[[2-(N-methylsulfonyl-4-propoxyanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-mesyl-4-propoxy-anilino)acetyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2C)C(=O)OCC)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2C)C(=O)OCC)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O6S/c1-5-14-30-18-12-10-17(11-13-18)24(31(4,27)28)15-21(25)23-20-9-7-8-19(16(20)3)22(26)29-6-2/h7-13H,5-6,14-15H2,1-4H3,(H,23,25)