1-(4-methoxyphenyl)-2-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-ium-1-yl]ethanone Formula: C23H29N2O6+ MolecularWeight: 429.48616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H28N2O6/c1-28-18-7-5-16(6-8-18)19(26)15-24-9-11-25(12-10-24)23(27)17-13-20(29-2)22(31-4)21(14-17)30-3/h5-8,13-14H,9-12,15H2,1-4H3/p+1