butyl 4-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: butyl 4-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]benzoate CAS Name: 4-[[[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-chloro-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(2-chloro-5-morpholinosulfonyl-benzoyl)amino]benzoic acid butyl ester Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C22H25ClN2O6S/c1-2-3-12-31-22(27)16-4-6-17(7-5-16)24-21(26)19-15-18(8-9-20(19)23)32(28,29)25-10-13-30-14-11-25/h4-9,15H,2-3,10-14H2,1H3,(H,24,26)