ethyl 4-[2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(4-p-anisylpiperazine-1,4-diium-1-yl)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H36N4O4+2 MolecularWeight: 420.54564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H34N4O4/c1-3-30-22(28)26-10-8-19(9-11-26)23-21(27)17-25-14-12-24(13-15-25)16-18-4-6-20(29-2)7-5-18/h4-7,19H,3,8-17H2,1-2H3,(H,23,27)/p+2