N-(4-methoxy-2-nitro-phenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(4-methoxy-2-nitrophenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-3-piperidinosulfonyl-benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-28-15-8-9-17(18(13-15)22(24)25)20-19(23)14-6-5-7-16(12-14)29(26,27)21-10-3-2-4-11-21/h5-9,12-13H,2-4,10-11H2,1H3,(H,20,23)