2-methyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide

Systemtic Name: 2-methyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: 2-methyl-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 2-methyl-N-(2-methyl-5-piperidinosulfonyl-phenyl)-3-nitro-benzamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O5S/c1-14-9-10-16(29(27,28)22-11-4-3-5-12-22)13-18(14)21-20(24)17-7-6-8-19(15(17)2)23(25)26/h6-10,13H,3-5,11-12H2,1-2H3,(H,21,24)