N-(2-chloranyl-5-nitro-phenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-(2-chloro-5-nitrophenyl)-3-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-3-[(4-esylpiperazino)methyl]benzamide Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H23ClN4O5S/c1-2-31(29,30)24-10-8-23(9-11-24)14-15-4-3-5-16(12-15)20(26)22-19-13-17(25(27)28)6-7-18(19)21/h3-7,12-13H,2,8-11,14H2,1H3,(H,22,26)