4-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-(5-fluoro-2-methoxy-benzyl)piperazino]-3-nitro-benzamide Formula: C19H21FN4O4 MolecularWeight: 388.392843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)F)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H21FN4O4/c1-28-18-5-3-15(20)10-14(18)12-22-6-8-23(9-7-22)16-4-2-13(19(21)25)11-17(16)24(26)27/h2-5,10-11H,6-9,12H2,1H3,(H2,21,25)