N-[3-(azepan-1-yl)propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(1-azepanyl)propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-nitro-benzenesulfonamide Formula: C15H23N3O4S MolecularWeight: 341.42582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O4S/c19-18(20)14-6-8-15(9-7-14)23(21,22)16-10-5-13-17-11-3-1-2-4-12-17/h6-9,16H,1-5,10-13H2