4-bromanyl-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-bromanyl-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-bromo-N-(3-nitrophenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-bromo-N-(3-nitrophenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-bromo-N-(3-nitrophenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-bromo-N-(3-nitrophenyl)-3-piperidinosulfonyl-benzamide Formula: C18H18BrN3O5S MolecularWeight: 468.32162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C18H18BrN3O5S/c19-16-8-7-13(11-17(16)28(26,27)21-9-2-1-3-10-21)18(23)20-14-5-4-6-15(12-14)22(24)25/h4-8,11-12H,1-3,9-10H2,(H,20,23)