N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitro-phenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitro-phenyl)-4-methyl-benzenesulfonamide Openeye Name: N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitro-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitrophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitrophenyl)-4-methylbenzenesulfonamide Traditional Name: N-[3-(diethylamino)propyl]-N-(4-methoxy-2-nitro-phenyl)-4-methyl-benzenesulfonamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O5S/c1-5-22(6-2)14-7-15-23(30(27,28)19-11-8-17(3)9-12-19)20-13-10-18(29-4)16-21(20)24(25)26/h8-13,16H,5-7,14-15H2,1-4H3