2-fluoranyl-6-[4-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[4-(3-methyl-1-piperidyl)-3-nitro-benzoyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-[4-(3-methylpiperidin-1-yl)-3-nitrobenzoyl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[4-(3-methylpiperidino)-3-nitro-benzoyl]piperazino]benzonitrile Formula: C24H26FN5O3 MolecularWeight: 451.493343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H26FN5O3/c1-17-4-3-9-29(16-17)22-8-7-18(14-23(22)30(32)33)24(31)28-12-10-27(11-13-28)21-6-2-5-20(25)19(21)15-26/h2,5-8,14,17H,3-4,9-13,16H2,1H3