N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)propane-1-sulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)propane-1-sulfonamide Openeye Name: N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)propane-1-sulfonamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)-1-propanesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)propane-1-sulfonamide Traditional Name: N-(2-dimethylaminoethyl)-N-(4-nitrophenyl)propane-1-sulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CCN(C)C)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N(CCN(C)C)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O4S/c1-4-11-21(19,20)15(10-9-14(2)3)12-5-7-13(8-6-12)16(17)18/h5-8H,4,9-11H2,1-3H3