3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-4-ethoxy-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-4-ethoxy-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[(4-chloro-3-nitro-phenyl)sulfonylamino]-4-ethoxy-N,N-diethyl-benzenesulfonamide CAS Name: 3-[(4-chloro-3-nitrophenyl)sulfonylamino]-4-ethoxy-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[(4-chloro-3-nitrophenyl)sulfonylamino]-4-ethoxy-N,N-diethylbenzenesulfonamide Traditional Name: 3-[(4-chloro-3-nitro-phenyl)sulfonylamino]-4-ethoxy-N,N-diethyl-benzenesulfonamide Formula: C18H22ClN3O7S2 MolecularWeight: 491.96618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H22ClN3O7S2/c1-4-21(5-2)31(27,28)14-8-10-18(29-6-3)16(11-14)20-30(25,26)13-7-9-15(19)17(12-13)22(23)24/h7-12,20H,4-6H2,1-3H3