ethyl 3-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoylamino]benzoate Openeye Name: ethyl 3-[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanoylamino]benzoate CAS Name: 3-[[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanoylamino]benzoate Traditional Name: 3-[2-(5-chloro-N-mesyl-2-methyl-anilino)propanoylamino]benzoic acid ethyl ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C20H23ClN2O5S/c1-5-28-20(25)15-7-6-8-17(11-15)22-19(24)14(3)23(29(4,26)27)18-12-16(21)10-9-13(18)2/h6-12,14H,5H2,1-4H3,(H,22,24)