2,6-bis(chloranyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 2,6-bis(chloranyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-nitro-benzenesulfonamide Openeye Name: 2,6-dichloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-nitro-benzenesulfonamide CAS Name: 2,6-dichloro-N-[(1-ethyl-2-pyrrolidinyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: 2,6-dichloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-nitrobenzenesulfonamide Traditional Name: 2,6-dichloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-3-nitro-benzenesulfonamide Formula: C13H17Cl2N3O4S MolecularWeight: 382.26278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNS(=O)(=O)C2=C(C=CC(=C2Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1CCCC1CNS(=O)(=O)C2=C(C=CC(=C2Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H17Cl2N3O4S/c1-2-17-7-3-4-9(17)8-16-23(21,22)13-10(14)5-6-11(12(13)15)18(19)20/h5-6,9,16H,2-4,7-8H2,1H3