methyl 3-[2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(4-chloro-3-morpholinosulfonyl-anilino)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[4-chloro-3-(4-morpholinylsulfonyl)anilino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-chloro-3-morpholin-4-ylsulfonylanilino)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(4-chloro-3-morpholinosulfonyl-anilino)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H24ClN3O6S MolecularWeight: 481.94976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H24ClN3O6S/c1-14-3-4-15(21(27)30-2)11-18(14)24-20(26)13-23-16-5-6-17(22)19(12-16)32(28,29)25-7-9-31-10-8-25/h3-6,11-12,23H,7-10,13H2,1-2H3,(H,24,26)