N-(2,3-dimethyl-6-nitro-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide CAS Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[4-(4-fluorophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide Traditional Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[4-(4-fluorophenyl)piperazino]acetamide Formula: C20H23FN4O3 MolecularWeight: 386.420023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H23FN4O3/c1-14-3-8-18(25(27)28)20(15(14)2)22-19(26)13-23-9-11-24(12-10-23)17-6-4-16(21)5-7-17/h3-8H,9-13H2,1-2H3,(H,22,26)