N-(1-cyano-3-methoxy-propyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-cyclohexane-1-carboxamide

Systemtic Name: N-(1-cyano-3-methoxy-propyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-cyclohexane-1-carboxamide Openeye Name: N-(1-cyano-3-methoxy-propyl)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexanecarboxamide CAS Name: N-(1-cyano-3-methoxypropyl)-2-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-1-cyclohexanecarboxamide IUPAC Name: N-(1-cyano-3-methoxypropyl)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxamide Traditional Name: N-(1-cyano-3-methoxy-propyl)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexanecarboxamide Formula: C23H31FN4O3 MolecularWeight: 430.515643

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(C#N)NC(=O)C1CCCCC1C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

COCCC(C#N)NC(=O)C1CCCCC1C(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H31FN4O3/c1-31-15-10-18(16-25)26-22(29)20-4-2-3-5-21(20)23(30)28-13-11-27(12-14-28)19-8-6-17(24)7-9-19/h6-9,18,20-21H,2-5,10-15H2,1H3,(H,26,29)