2-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-ethyl-ethanamide

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-ethyl-ethanamide Openeye Name: 2-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-ethyl-acetamide CAS Name: 2-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-N-ethylacetamide IUPAC Name: 2-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-N-ethylacetamide Traditional Name: 2-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazino]-N-ethyl-acetamide Formula: C15H21ClN4O5S MolecularWeight: 404.86904

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C15H21ClN4O5S/c1-3-17-15(21)10-18-4-6-19(7-5-18)26(24,25)12-8-13(16)11(2)14(9-12)20(22)23/h8-9H,3-7,10H2,1-2H3,(H,17,21)