N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-(ethylamino)propyl]-3,4-dimethyl-5-nitro-benzenesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O4S/c1-4-14-6-5-7-15-21(19,20)12-8-10(2)11(3)13(9-12)16(17)18/h8-9,14-15H,4-7H2,1-3H3