N-[3-[ethyl(phenyl)amino]propyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-(N-ethylanilino)propyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-(N-ethylanilino)propyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-2-nitrobenzenesulfonamide Traditional Name: N-[3-(N-ethylanilino)propyl]-2-nitro-benzenesulfonamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CCN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O4S/c1-2-19(15-9-4-3-5-10-15)14-8-13-18-25(23,24)17-12-7-6-11-16(17)20(21)22/h3-7,9-12,18H,2,8,13-14H2,1H3