ethyl 4-[(2R)-2-(3-pyridin-4-ylpropylcarbamoyl)-6-azoniaspiro[2.5]octan-6-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2R)-2-(3-pyridin-4-ylpropylcarbamoyl)-6-azoniaspiro[2.5]octan-6-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2R)-2-[3-(4-pyridyl)propylcarbamoyl]-6-azoniaspiro[2.5]octan-6-yl]piperidine-1-carboxylate CAS Name: 4-[(2R)-2-[oxo-(3-pyridin-4-ylpropylamino)methyl]-6-azoniaspiro[2.5]octan-6-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-2-(3-pyridin-4-ylpropylcarbamoyl)-6-azoniaspiro[2.5]octan-6-yl]piperidine-1-carboxylate Traditional Name: 4-[(2R)-2-[3-(4-pyridyl)propylcarbamoyl]-6-azoniaspiro[2.5]octan-6-yl]piperidine-1-carboxylic acid ethyl ester Formula: C24H37N4O3+ MolecularWeight: 429.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH+]2CCC3(CC2)CC3C(=O)NCCCC4=CC=NC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH+]2CCC3(CC2)C[C@H]3C(=O)NCCCC4=CC=NC=C4

InChI

InChI=1S/C24H36N4O3/c1-2-31-23(30)28-14-7-20(8-15-28)27-16-9-24(10-17-27)18-21(24)22(29)26-11-3-4-19-5-12-25-13-6-19/h5-6,12-13,20-21H,2-4,7-11,14-18H2,1H3,(H,26,29)/p+1/t21-/m0/s1