N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C14H23N3O4S MolecularWeight: 329.41512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O4S/c1-11-6-7-12(8-13(11)17(18)19)22(20,21)15-9-14(2,3)10-16(4)5/h6-8,15H,9-10H2,1-5H3