N-(2-methoxy-5-nitro-phenyl)-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]methanesulfonamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]methanesulfonamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]methanesulfonamide CAS Name: N-(2-methoxy-5-nitrophenyl)-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]methanesulfonamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]methanesulfonamide Traditional Name: N-[2-keto-2-(4-phenylpiperazino)ethyl]-N-(2-methoxy-5-nitro-phenyl)methanesulfonamide Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H24N4O6S/c1-30-19-9-8-17(24(26)27)14-18(19)23(31(2,28)29)15-20(25)22-12-10-21(11-13-22)16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3