1-(4-nitrophenyl)-N-[3-(propan-2-ylamino)propyl]methanesulfonamide

Systemtic Name: 1-(4-nitrophenyl)-N-[3-(propan-2-ylamino)propyl]methanesulfonamide Openeye Name: N-[3-(isopropylamino)propyl]-1-(4-nitrophenyl)methanesulfonamide CAS Name: 1-(4-nitrophenyl)-N-[3-(propan-2-ylamino)propyl]methanesulfonamide IUPAC Name: 1-(4-nitrophenyl)-N-[3-(propan-2-ylamino)propyl]methanesulfonamide Traditional Name: N-[3-(isopropylamino)propyl]-1-(4-nitrophenyl)methanesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCNS(=O)(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)NCCCNS(=O)(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O4S/c1-11(2)14-8-3-9-15-21(19,20)10-12-4-6-13(7-5-12)16(17)18/h4-7,11,14-15H,3,8-10H2,1-2H3