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

Systemtic Name: 2-bromanyl-N-(2-methyl-5-nitro-phenyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(2-methyl-5-nitro-phenyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-bromo-N-(2-methyl-5-nitrophenyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(2-methyl-5-nitrophenyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(2-methyl-5-nitro-phenyl)-5-piperidinosulfonyl-benzamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O5S/c1-13-5-6-14(23(25)26)11-18(13)21-19(24)16-12-15(7-8-17(16)20)29(27,28)22-9-3-2-4-10-22/h5-8,11-12H,2-4,9-10H2,1H3,(H,21,24)