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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H24ClN3O6S/c1-14-11-15(21(27)30-2)3-6-18(14)23-13-20(26)24-16-4-5-17(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)