3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-nitro-benzamide

Systemtic Name: 3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-nitro-benzamide Openeye Name: 3-methyl-N-(1-methylsulfonyl-4-piperidyl)-4-nitro-benzamide CAS Name: 3-methyl-N-(1-methylsulfonyl-4-piperidinyl)-4-nitrobenzamide IUPAC Name: 3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-nitrobenzamide Traditional Name: N-(1-mesyl-4-piperidyl)-3-methyl-4-nitro-benzamide Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCN(CC2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCN(CC2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-10-9-11(3-4-13(10)17(19)20)14(18)15-12-5-7-16(8-6-12)23(2,21)22/h3-4,9,12H,5-8H2,1-2H3,(H,15,18)