tert-butyl (2S)-2-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]pentylamino]-3-oxidanyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]pentylamino]-3-oxidanyl-propanoate Openeye Name: tert-butyl (2S)-2-[5-(2,4-dioxopyrimidin-1-yl)pentylamino]-3-hydroxy-propanoate CAS Name: (2S)-2-[5-(2,4-dioxo-1-pyrimidinyl)pentylamino]-3-hydroxypropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[5-(2,4-dioxopyrimidin-1-yl)pentylamino]-3-hydroxypropanoate Traditional Name: (2S)-2-[5-(2,4-diketopyrimidin-1-yl)pentylamino]-3-hydroxy-propionic acid tert-butyl ester Formula: C16H27N3O5 MolecularWeight: 341.40268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CO)NCCCCCN1C=CC(=O)NC1=O

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CO)NCCCCCN1C=CC(=O)NC1=O

InChI

InChI=1S/C16H27N3O5/c1-16(2,3)24-14(22)12(11-20)17-8-5-4-6-9-19-10-7-13(21)18-15(19)23/h7,10,12,17,20H,4-6,8-9,11H2,1-3H3,(H,18,21,23)/t12-/m0/s1