ethyl 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-4-ium-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-4-ium-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-4-ium-1-yl]piperidine-1-carboxylate CAS Name: 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)-1-piperazin-4-iumyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-4-ium-1-yl]piperidine-1-carboxylate Traditional Name: 4-[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-4-ium-1-yl]piperidine-1-carboxylic acid ethyl ester Formula: C19H36N3O3+ MolecularWeight: 354.50744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CC[NH+](C(C2)CCO)C3CCCC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CC[NH+]([C@H](C2)CCO)C3CCCC3

InChI

InChI=1S/C19H35N3O3/c1-2-25-19(24)20-10-7-16(8-11-20)21-12-13-22(17-5-3-4-6-17)18(15-21)9-14-23/h16-18,23H,2-15H2,1H3/p+1/t18-/m0/s1