N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[2-[bis[3-(dimethylamino)propyl]amino]ethyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C18H32ClN5O4S MolecularWeight: 449.99578

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)CCNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)CCNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H32ClN5O4S/c1-21(2)10-5-12-23(13-6-11-22(3)4)14-9-20-29(27,28)16-7-8-17(19)18(15-16)24(25)26/h7-8,15,20H,5-6,9-14H2,1-4H3