3-pyridin-3-ylpropyl 3-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-1,3-dimethyl-piperidine-2-carboxylate

Systemtic Name: 3-pyridin-3-ylpropyl 3-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-1,3-dimethyl-piperidine-2-carboxylate Openeye Name: 3-(3-pyridyl)propyl 3-(3,3-dimethyl-2-oxo-pentanoyl)-1,3-dimethyl-piperidine-2-carboxylate CAS Name: 3-(3,3-dimethyl-1,2-dioxopentyl)-1,3-dimethyl-2-piperidinecarboxylic acid 3-(3-pyridinyl)propyl ester IUPAC Name: 3-pyridin-3-ylpropyl 3-(3,3-dimethyl-2-oxopentanoyl)-1,3-dimethylpiperidine-2-carboxylate Traditional Name: 3-(2-keto-3,3-dimethyl-pentanoyl)-1,3-dimethyl-pipecolinic acid 3-(3-pyridyl)propyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)C1(CCCN(C1C(=O)OCCCC2=CN=CC=C2)C)C

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)C1(CCCN(C1C(=O)OCCCC2=CN=CC=C2)C)C

InChI

InChI=1S/C23H34N2O4/c1-6-22(2,3)19(26)20(27)23(4)12-9-14-25(5)18(23)21(28)29-15-8-11-17-10-7-13-24-16-17/h7,10,13,16,18H,6,8-9,11-12,14-15H2,1-5H3