(E)-2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-3-(4-piperidin-1-ylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-3-(4-piperidin-1-ylphenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-[4-(1-piperidyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-3-[4-(1-piperidinyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(4-piperidin-1-ylphenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(4-piperidinophenyl)acrylonitrile Formula: C25H27FN4O MolecularWeight: 418.506483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=C(C#N)C(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C(\C#N)/C(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C25H27FN4O/c26-23-6-2-3-7-24(23)29-14-16-30(17-15-29)25(31)21(19-27)18-20-8-10-22(11-9-20)28-12-4-1-5-13-28/h2-3,6-11,18H,1,4-5,12-17H2/b21-18+