1-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]propan-2-ylcarbamic acid

Systemtic Name: 1-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]propan-2-ylcarbamic acid Openeye Name: [2-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]-1-methyl-ethyl]carbamic acid CAS Name: 1-[(4-chlorophenyl)sulfonyl-(2-oxo-3-azepanyl)amino]propan-2-ylcarbamic acid IUPAC Name: 1-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]propan-2-ylcarbamic acid Traditional Name: [2-[(4-chlorophenyl)sulfonyl-(2-ketoazepan-3-yl)amino]-1-methyl-ethyl]carbamic acid Formula: C16H22ClN3O5S MolecularWeight: 403.88098

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl)NC(=O)O

Isomeric SMILES

CC(CN(C1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl)NC(=O)O

InChI

InChI=1S/C16H22ClN3O5S/c1-11(19-16(22)23)10-20(14-4-2-3-9-18-15(14)21)26(24,25)13-7-5-12(17)6-8-13/h5-8,11,14,19H,2-4,9-10H2,1H3,(H,18,21)(H,22,23)