(E)-3-(2-butyl-1-benzofuran-3-yl)-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-butyl-1-benzofuran-3-yl)-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-(2-butylbenzofuran-3-yl)prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-(2-butyl-3-benzofuranyl)-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-(2-butyl-1-benzofuran-3-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-(2-butylbenzofuran-3-yl)prop-2-en-1-one Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C=CC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H26N2O3/c1-3-4-8-19-18(17-7-5-6-9-20(17)26-19)10-11-21(25)23-14-12-22(13-15-23)16(2)24/h5-7,9-11H,3-4,8,12-15H2,1-2H3/b11-10+