tert-butyl 4-[[5-(4-aminocarbonylphenyl)pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-(4-aminocarbonylphenyl)pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(4-carbamoylphenyl)pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(4-carbamoylphenyl)-2-pyrimidinyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-(4-carbamoylphenyl)pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-carbamoylphenyl)pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=N2)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=N2)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H28N4O4/c1-22(2,3)30-21(28)26-10-8-15(9-11-26)14-29-20-24-12-18(13-25-20)16-4-6-17(7-5-16)19(23)27/h4-7,12-13,15H,8-11,14H2,1-3H3,(H2,23,27)