methyl 2-[4-(2-methoxy-2-oxidanylidene-ethyl)-1,4-bis(phenylmethyl)piperazine-1,4-diium-1-yl]ethanoate

Systemtic Name: methyl 2-[4-(2-methoxy-2-oxidanylidene-ethyl)-1,4-bis(phenylmethyl)piperazine-1,4-diium-1-yl]ethanoate Openeye Name: methyl 2-[1,4-dibenzyl-4-(2-methoxy-2-oxo-ethyl)piperazine-1,4-diium-1-yl]acetate CAS Name: 2-[4-(2-methoxy-2-oxoethyl)-1,4-bis(phenylmethyl)-1-piperazine-1,4-diiumyl]acetic acid methyl ester IUPAC Name: methyl 2-[1,4-dibenzyl-4-(2-methoxy-2-oxoethyl)piperazine-1,4-diium-1-yl]acetate Traditional Name: 2-[1,4-dibenzyl-4-(2-keto-2-methoxy-ethyl)piperazine-1,4-diium-1-yl]acetic acid methyl ester Formula: C24H32N2O4+2 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[N+]1(CC[N+](CC1)(CC2=CC=CC=C2)CC(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C[N+]1(CC[N+](CC1)(CC2=CC=CC=C2)CC(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O4/c1-29-23(27)19-25(17-21-9-5-3-6-10-21)13-15-26(16-14-25,20-24(28)30-2)18-22-11-7-4-8-12-22/h3-12H,13-20H2,1-2H3/q+2