4-nitro-N-(1-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-nitro-N-(1-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-nitro-N-(1-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-nitro-N-[1-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-nitro-N-(1-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-nitro-N-(1-pyrrolidinoethyl)benzenesulfonamide Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(NS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CC(NS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C12H17N3O4S/c1-10(14-8-2-3-9-14)13-20(18,19)12-6-4-11(5-7-12)15(16)17/h4-7,10,13H,2-3,8-9H2,1H3