4-ethoxy-N-[2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-ethoxy-N-[2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-ethoxy-N-[2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 4-ethoxy-N-[2-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 4-ethoxy-N-[2-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: 4-ethoxy-N-[2-keto-2-[4-(4-mesyl-2-nitro-phenyl)piperazino]ethyl]benzamide Formula: C22H26N4O7S MolecularWeight: 490.52944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O7S/c1-3-33-17-6-4-16(5-7-17)22(28)23-15-21(27)25-12-10-24(11-13-25)19-9-8-18(34(2,31)32)14-20(19)26(29)30/h4-9,14H,3,10-13,15H2,1-2H3,(H,23,28)