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

Systemtic Name: methyl 3-[[2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 3-[[2-(4-methoxy-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]amino]benzoate CAS Name: 3-[[2-[4-methoxy-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-methoxy-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]amino]benzoate Traditional Name: 3-[[2-keto-2-(4-methoxy-3-morpholinosulfonyl-anilino)ethyl]amino]benzoic acid methyl ester Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CNC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CNC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25N3O7S/c1-29-18-7-6-17(13-19(18)32(27,28)24-8-10-31-11-9-24)23-20(25)14-22-16-5-3-4-15(12-16)21(26)30-2/h3-7,12-13,22H,8-11,14H2,1-2H3,(H,23,25)