2-methyl-5-nitro-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-(3-pyrrolidinopropyl)benzenesulfonamide Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCCC2

InChI

InChI=1S/C14H21N3O4S/c1-12-5-6-13(17(18)19)11-14(12)22(20,21)15-7-4-10-16-8-2-3-9-16/h5-6,11,15H,2-4,7-10H2,1H3