ethyl 4-(4-phenylpiperazin-1-ium-1-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(4-phenylpiperazin-1-ium-1-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(4-phenylpiperazin-1-ium-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-phenylpiperazin-1-ium-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-phenylpiperazin-1-ium-1-yl)piperidine-1-carboxylic acid ethyl ester Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2/c1-2-23-18(22)21-10-8-17(9-11-21)20-14-12-19(13-15-20)16-6-4-3-5-7-16/h3-7,17H,2,8-15H2,1H3/p+1