3-fluoranyl-4-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbonyl-benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]carbonyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-fluoro-4-[[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-fluoro-4-[4-(4-methoxy-2-nitrophenyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-fluoro-4-[4-(4-methoxy-2-nitro-phenyl)piperazine-1-carbonyl]benzonitrile Formula: C19H17FN4O4 MolecularWeight: 384.361083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)C#N)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)C#N)F)[N+](=O)[O-]

InChI

InChI=1S/C19H17FN4O4/c1-28-14-3-5-17(18(11-14)24(26)27)22-6-8-23(9-7-22)19(25)15-4-2-13(12-21)10-16(15)20/h2-5,10-11H,6-9H2,1H3