ethyl 4-[4-(phenylmethyl)piperazin-1-ium-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-(phenylmethyl)piperazin-1-ium-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-(4-benzylpiperazin-1-ium-1-yl)piperidine-1-carboxylate CAS Name: 4-[4-(phenylmethyl)-1-piperazin-1-iumyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-benzylpiperazin-1-ium-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-benzylpiperazin-1-ium-1-yl)piperidine-1-carboxylic acid ethyl ester Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O2/c1-2-24-19(23)22-10-8-18(9-11-22)21-14-12-20(13-15-21)16-17-6-4-3-5-7-17/h3-7,18H,2,8-16H2,1H3/p+1