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

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-nitro-benzamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-2-nitro-benzamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-2-nitrobenzamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-nitrobenzamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-2-nitro-benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-28-18-10-9-14(29(26,27)21-11-5-2-6-12-21)13-16(18)20-19(23)15-7-3-4-8-17(15)22(24)25/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,20,23)