4-[2-(4-chloranylphenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(4-chloranylphenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(4-chlorophenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide CAS Name: 4-[2-(4-chlorophenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(4-chlorophenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(4-chlorophenoxy)ethylamino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide Formula: C18H23ClN4O5S MolecularWeight: 442.91702

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)NCCOC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)NCCOC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H23ClN4O5S/c1-22(2)11-9-21-29(26,27)16-7-8-17(18(13-16)23(24)25)20-10-12-28-15-5-3-14(19)4-6-15/h3-8,13,20-21H,9-12H2,1-2H3