N-(2-chloranylpyridin-3-yl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]acetamide Formula: C18H20ClN5O6S MolecularWeight: 469.8993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(N=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(N=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN5O6S/c1-30-16-5-4-13(11-15(16)24(26)27)31(28,29)23-9-7-22(8-10-23)12-17(25)21-14-3-2-6-20-18(14)19/h2-6,11H,7-10,12H2,1H3,(H,21,25)