(E)-3-(2-ethyl-1-benzofuran-3-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-ethyl-1-benzofuran-3-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-ethylbenzofuran-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]prop-2-enenitrile CAS Name: (E)-3-(2-ethyl-3-benzofuranyl)-2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2-ethyl-1-benzofuran-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]prop-2-enenitrile Traditional Name: (E)-3-(2-ethylbenzofuran-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]acrylonitrile Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=C(C#N)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C(\C#N)/C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H25N3O3/c1-3-23-22(21-6-4-5-7-24(21)31-23)16-18(17-26)25(29)28-14-12-27(13-15-28)19-8-10-20(30-2)11-9-19/h4-11,16H,3,12-15H2,1-2H3/b18-16+