4-[2-(3-chloranylphenoxy)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(3-chloranylphenoxy)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(3-chlorophenoxy)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(3-chlorophenoxy)ethyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(3-chlorophenoxy)ethyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(3-chlorophenoxy)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C16H18ClN3O5S MolecularWeight: 399.84922

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H18ClN3O5S/c1-18-26(23,24)14-6-7-15(16(11-14)20(21)22)19(2)8-9-25-13-5-3-4-12(17)10-13/h3-7,10-11,18H,8-9H2,1-2H3