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

Systemtic Name: (E)-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-(2-methylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-(o-tolyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(4-ethoxyphenyl)methyl]-1-piperazin-4-iumyl]-3-(2-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-(2-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-ethoxybenzyl)piperazin-4-ium-1-yl]-3-(o-tolyl)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[NH+]2CCN(CC2)C(=O)C=CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3C

InChI

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