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

Systemtic Name: (E)-2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-3-(2-methoxynaphthalen-1-yl)prop-2-enenitrile Openeye Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxy-1-naphthyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-3-(2-methoxy-1-naphthalenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxynaphthalen-1-yl)prop-2-enenitrile Traditional Name: (E)-2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxy-1-naphthyl)acrylonitrile Formula: C25H22FN3O2 MolecularWeight: 415.459483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)C=C(C#N)C(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)/C=C(\C#N)/C(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C25H22FN3O2/c1-31-24-11-10-18-6-2-3-7-20(18)21(24)16-19(17-27)25(30)29-14-12-28(13-15-29)23-9-5-4-8-22(23)26/h2-11,16H,12-15H2,1H3/b19-16+