N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(methylamino)-5-nitro-benzamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-2-(methylamino)-5-nitro-benzamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)-5-nitrobenzamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-2-(methylamino)-5-nitro-benzamide Formula: C19H21ClN4O5S MolecularWeight: 452.91184

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H21ClN4O5S/c1-21-17-8-6-14(24(26)27)12-15(17)19(25)22-13-5-7-16(20)18(11-13)30(28,29)23-9-3-2-4-10-23/h5-8,11-12,21H,2-4,9-10H2,1H3,(H,22,25)