ethyl 4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H31N4O4+ MolecularWeight: 391.48454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H30N4O4/c1-3-28-20(26)24-14-12-23(13-15-24)19(25)16-21-8-10-22(11-9-21)17-4-6-18(27-2)7-5-17/h4-7H,3,8-16H2,1-2H3/p+1