N,N-diethyl-3-nitro-4-[(phenylmethyl)amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(phenylmethyl)amino]benzenesulfonamide Openeye Name: 4-(benzylamino)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[(phenylmethyl)amino]benzenesulfonamide IUPAC Name: 4-(benzylamino)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(benzylamino)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S/c1-3-19(4-2)25(23,24)15-10-11-16(17(12-15)20(21)22)18-13-14-8-6-5-7-9-14/h5-12,18H,3-4,13H2,1-2H3