2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-ethyl-amino]-N-ethyl-ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-ethyl-amino]-N-ethyl-ethanamide Openeye Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-ethyl-amino]-N-ethyl-acetamide CAS Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-ethylamino]-N-ethylacetamide IUPAC Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-ethylamino]-N-ethylacetamide Traditional Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-ethyl-amino]-N-ethyl-acetamide Formula: C13H18ClN3O5S MolecularWeight: 363.81712

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN(CC)S(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCNC(=O)CN(CC)S(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C13H18ClN3O5S/c1-4-15-13(18)8-16(5-2)23(21,22)10-6-11(14)9(3)12(7-10)17(19)20/h6-7H,4-5,8H2,1-3H3,(H,15,18)