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

Systemtic Name: 4-methyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: 4-methyl-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 4-methyl-N-(4-methyl-3-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)C(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

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