4-imidazol-1-yl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-imidazol-1-yl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: 4-imidazol-1-yl-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-imidazol-1-yl-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 4-imidazol-1-yl-N-(4-methyl-3-piperidinosulfonyl-phenyl)-3-nitro-benzamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H23N5O5S/c1-16-5-7-18(14-21(16)33(31,32)26-10-3-2-4-11-26)24-22(28)17-6-8-19(20(13-17)27(29)30)25-12-9-23-15-25/h5-9,12-15H,2-4,10-11H2,1H3,(H,24,28)