methyl 5-oxidanylidene-5-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]pentanoate Openeye Name: methyl 5-oxo-5-[3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]pentanoate CAS Name: 5-oxo-5-[3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]pentanoate Traditional Name: 5-keto-5-[3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]valeric acid methyl ester Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N1CCC(C1)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC(=O)CCCC(=O)N1CCC(C1)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H28N4O3/c1-26-18(25)5-2-4-17(24)23-13-8-16(14-23)15-6-11-22(12-7-15)19-20-9-3-10-21-19/h3,9-10,15-16H,2,4-8,11-14H2,1H3