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

Systemtic Name: methyl 4-oxidanylidene-4-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]butanoate Openeye Name: methyl 4-oxo-4-[3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]butanoate CAS Name: 4-oxo-4-[3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]butanoate Traditional Name: 4-keto-4-[3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]butyric acid methyl ester Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O3/c1-25-17(24)4-3-16(23)22-12-7-15(13-22)14-5-10-21(11-6-14)18-19-8-2-9-20-18/h2,8-9,14-15H,3-7,10-13H2,1H3