2-[4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(3-fluoro-4-methoxy-benzoyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(3-fluoro-4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(3-fluoro-4-methoxybenzoyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(3-fluoro-4-methoxy-benzoyl)piperazino]isonicotinonitrile Formula: C18H17FN4O2 MolecularWeight: 340.351583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)F

InChI

InChI=1S/C18H17FN4O2/c1-25-16-3-2-14(11-15(16)19)18(24)23-8-6-22(7-9-23)17-10-13(12-20)4-5-21-17/h2-5,10-11H,6-9H2,1H3