ethyl 4-[[2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(4-morpholinosulfonylphenyl)methylamino]-2-oxo-acetyl]amino]benzoate CAS Name: 4-[[2-[[4-(4-morpholinylsulfonyl)phenyl]methylamino]-1,2-dioxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxoacetyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[(4-morpholinosulfonylbenzyl)amino]acetyl]amino]benzoic acid ethyl ester Formula: C22H25N3O7S MolecularWeight: 475.5148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H25N3O7S/c1-2-32-22(28)17-5-7-18(8-6-17)24-21(27)20(26)23-15-16-3-9-19(10-4-16)33(29,30)25-11-13-31-14-12-25/h3-10H,2,11-15H2,1H3,(H,23,26)(H,24,27)