4-methoxy-3-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide

Systemtic Name: 4-methoxy-3-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Openeye Name: 4-methoxy-3-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide CAS Name: 4-methoxy-3-nitro-N-[3-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-3-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 4-methoxy-3-nitro-N-(3-pyrrolidinosulfonylphenyl)benzenesulfonamide Formula: C17H19N3O7S2 MolecularWeight: 441.47866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O7S2/c1-27-17-8-7-14(12-16(17)20(21)22)28(23,24)18-13-5-4-6-15(11-13)29(25,26)19-9-2-3-10-19/h4-8,11-12,18H,2-3,9-10H2,1H3