2-(3-methyl-4-nitro-phenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-methyl-4-nitro-phenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(3-methyl-4-nitro-phenoxy)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(3-methyl-4-nitrophenoxy)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-methyl-4-nitrophenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(3-methyl-4-nitro-phenoxy)-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O6S/c1-17-14-20(7-9-22(17)26(28)29)32-16-23(27)24-10-12-25(13-11-24)33(30,31)21-8-6-18-4-2-3-5-19(18)15-21/h2-9,14-15H,10-13,16H2,1H3