N,N-diethyl-3-nitro-4-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]oxy-benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]oxy-benzenesulfonamide Openeye Name: N,N-diethyl-4-[1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]oxybenzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]oxybenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-keto-1-methyl-2-(4-phenylpiperazino)ethoxy]-3-nitro-benzenesulfonamide Formula: C23H30N4O6S MolecularWeight: 490.5725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O6S/c1-4-26(5-2)34(31,32)20-11-12-22(21(17-20)27(29)30)33-18(3)23(28)25-15-13-24(14-16-25)19-9-7-6-8-10-19/h6-12,17-18H,4-5,13-16H2,1-3H3