(E)-1-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(p-tolyl)-3-(2-pyrrolidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one CAS Name: (E)-1-(4-methylphenyl)-3-[2-(1-pyrrolidin-1-iumyl)-3H-inden-1-yl]-2-propen-1-one IUPAC Name: (E)-1-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(p-tolyl)-3-(2-pyrrolidin-1-ium-1-yl-3H-inden-1-yl)prop-2-en-1-one Formula: C23H24NO+ MolecularWeight: 330.44276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=C(CC3=CC=CC=C32)[NH+]4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=C(CC3=CC=CC=C32)[NH+]4CCCC4

InChI

InChI=1S/C23H23NO/c1-17-8-10-18(11-9-17)23(25)13-12-21-20-7-3-2-6-19(20)16-22(21)24-14-4-5-15-24/h2-3,6-13H,4-5,14-16H2,1H3/p+1/b13-12+