(E)-3-(4-ethoxyphenyl)-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-ethoxyphenyl)-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-ethoxyphenyl)-1-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-ethoxyphenyl)-1-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-2-propen-1-one IUPAC Name: (E)-3-(4-ethoxyphenyl)-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]-3-p-phenetyl-prop-2-en-1-one Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C23H28N2O2/c1-3-27-22-11-8-20(9-12-22)10-13-23(26)25-16-14-24(15-17-25)18-21-7-5-4-6-19(21)2/h4-13H,3,14-18H2,1-2H3/p+1/b13-10+