3-methyl-2-nitro-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 3-methyl-2-nitro-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-methyl-2-nitro-benzamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-methyl-2-nitrobenzamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-3-methyl-2-nitro-benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

InChI

InChI=1S/C18H19N3O6S/c1-12-5-4-6-14(17(12)21(24)25)18(23)19-15-11-13(7-8-16(15)22)28(26,27)20-9-2-3-10-20/h4-8,11,22H,2-3,9-10H2,1H3,(H,19,23)