N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-methyl-3-nitro-benzamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-methyl-3-nitrobenzamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-2-methyl-3-nitro-benzamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C20H23N3O6S/c1-14-16(7-6-8-18(14)23(25)26)20(24)21-17-13-15(9-10-19(17)29-2)30(27,28)22-11-4-3-5-12-22/h6-10,13H,3-5,11-12H2,1-2H3,(H,21,24)