N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[3-(cyclopropylamino)propyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCNC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCNC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4S/c1-10-3-6-12(9-13(10)16(17)18)21(19,20)15-8-2-7-14-11-4-5-11/h3,6,9,11,14-15H,2,4-5,7-8H2,1H3