N,N-diethyl-4-(2-methylpropylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-(2-methylpropylamino)-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-(isobutylamino)-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-(2-methylpropylamino)-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-(2-methylpropylamino)-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-(isobutylamino)-3-nitro-benzenesulfonamide Formula: C14H23N3O4S MolecularWeight: 329.41512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O4S/c1-5-16(6-2)22(20,21)12-7-8-13(15-10-11(3)4)14(9-12)17(18)19/h7-9,11,15H,5-6,10H2,1-4H3