(E)-1-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one CAS Name: (E)-1-(4-methoxyphenyl)-3-[2-(1-piperidin-1-iumyl)-3H-inden-1-yl]-2-propen-1-one IUPAC Name: (E)-1-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Formula: C24H26NO2+ MolecularWeight: 360.46874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C=CC2=C(CC3=CC=CC=C32)[NH+]4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C=C/C2=C(CC3=CC=CC=C32)[NH+]4CCCCC4

InChI

InChI=1S/C24H25NO2/c1-27-20-11-9-18(10-12-20)24(26)14-13-22-21-8-4-3-7-19(21)17-23(22)25-15-5-2-6-16-25/h3-4,7-14H,2,5-6,15-17H2,1H3/p+1/b14-13+