(E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(4-ethylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(4-ethylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[3-(1H-benzimidazol-2-yl)-1-piperidyl]-3-(4-ethylphenyl)prop-2-en-1-one CAS Name: (E)-1-[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-3-(4-ethylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(4-ethylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[3-(1H-benzimidazol-2-yl)piperidino]-3-(4-ethylphenyl)prop-2-en-1-one Formula: C23H25N3O MolecularWeight: 359.4641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H25N3O/c1-2-17-9-11-18(12-10-17)13-14-22(27)26-15-5-6-19(16-26)23-24-20-7-3-4-8-21(20)25-23/h3-4,7-14,19H,2,5-6,15-16H2,1H3,(H,24,25)/b14-13+