tert-butyl 4-(pyrimidin-4-yloxymethyl)piperidine-1-carboxylate; ethane

Systemtic Name: tert-butyl 4-(pyrimidin-4-yloxymethyl)piperidine-1-carboxylate; ethane Openeye Name: tert-butyl 4-(pyrimidin-4-yloxymethyl)piperidine-1-carboxylate; ethane CAS Name: ethane; 4-(4-pyrimidinyloxymethyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(pyrimidin-4-yloxymethyl)piperidine-1-carboxylate; ethane Traditional Name: ethane; 4-(4-pyrimidyloxymethyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C17H29N3O3 MolecularWeight: 323.43046

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Descriptors Computed from Structure

Canonical SMILES:

CC.CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=NC=C2

Isomeric SMILES

CC.CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=NC=C2

InChI

InChI=1S/C15H23N3O3.C2H6/c1-15(2,3)21-14(19)18-8-5-12(6-9-18)10-20-13-4-7-16-11-17-13;1-2/h4,7,11-12H,5-6,8-10H2,1-3H3;1-2H3