2-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]ethylcarbamic acid

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-(2-oxidanylideneazepan-3-yl)amino]ethylcarbamic acid Openeye Name: 2-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]ethylcarbamic acid CAS Name: 2-[(4-chlorophenyl)sulfonyl-(2-oxo-3-azepanyl)amino]ethylcarbamic acid IUPAC Name: 2-[(4-chlorophenyl)sulfonyl-(2-oxoazepan-3-yl)amino]ethylcarbamic acid Traditional Name: 2-[(4-chlorophenyl)sulfonyl-(2-ketoazepan-3-yl)amino]ethylcarbamic acid Formula: C15H20ClN3O5S MolecularWeight: 389.8544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CCNC(=O)O)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CCNC(=O)O)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H20ClN3O5S/c16-11-4-6-12(7-5-11)25(23,24)19(10-9-18-15(21)22)13-3-1-2-8-17-14(13)20/h4-7,13,18H,1-3,8-10H2,(H,17,20)(H,21,22)