tert-butyl (2S)-4-methyl-2-[[6-[3-(oxidanylamino)-3-oxidanylidene-propyl]pyridin-3-yl]methylamino]pentanoate

Systemtic Name: tert-butyl (2S)-4-methyl-2-[[6-[3-(oxidanylamino)-3-oxidanylidene-propyl]pyridin-3-yl]methylamino]pentanoate Openeye Name: tert-butyl (2S)-2-[[6-[3-(hydroxyamino)-3-oxo-propyl]-3-pyridyl]methylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[6-[3-(hydroxyamino)-3-oxopropyl]-3-pyridinyl]methylamino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[6-[3-(hydroxyamino)-3-oxopropyl]pyridin-3-yl]methylamino]-4-methylpentanoate Traditional Name: (2S)-2-[[6-[3-(hydroxyamino)-3-keto-propyl]-3-pyridyl]methylamino]-4-methyl-valeric acid tert-butyl ester Formula: C19H31N3O4 MolecularWeight: 365.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)(C)C)NCC1=CN=C(C=C1)CCC(=O)NO

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC(C)(C)C)NCC1=CN=C(C=C1)CCC(=O)NO

InChI

InChI=1S/C19H31N3O4/c1-13(2)10-16(18(24)26-19(3,4)5)21-12-14-6-7-15(20-11-14)8-9-17(23)22-25/h6-7,11,13,16,21,25H,8-10,12H2,1-5H3,(H,22,23)/t16-/m0/s1