tert-butyl (3R,4S,5S)-4-[[(2S)-2-azanyl-3-methyl-butanoyl]-methyl-amino]-5-methyl-3-oxidanyl-heptanoate

Systemtic Name: tert-butyl (3R,4S,5S)-4-[[(2S)-2-azanyl-3-methyl-butanoyl]-methyl-amino]-5-methyl-3-oxidanyl-heptanoate Openeye Name: tert-butyl (3R,4S,5S)-4-[[(2S)-2-amino-3-methyl-butanoyl]-methyl-amino]-3-hydroxy-5-methyl-heptanoate CAS Name: (3R,4S,5S)-4-[[(2S)-2-amino-3-methyl-1-oxobutyl]-methylamino]-3-hydroxy-5-methylheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-hydroxy-5-methylheptanoate Traditional Name: (3R,4S,5S)-4-[[(2S)-2-amino-3-methyl-butanoyl]-methyl-amino]-3-hydroxy-5-methyl-enanthic acid tert-butyl ester Formula: C18H36N2O4 MolecularWeight: 344.48944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(CC(=O)OC(C)(C)C)O)N(C)C(=O)C(C(C)C)N

Isomeric SMILES

CC[C@H](C)[C@@H]([C@@H](CC(=O)OC(C)(C)C)O)N(C)C(=O)[C@H](C(C)C)N

InChI

InChI=1S/C18H36N2O4/c1-9-12(4)16(20(8)17(23)15(19)11(2)3)13(21)10-14(22)24-18(5,6)7/h11-13,15-16,21H,9-10,19H2,1-8H3/t12-,13+,15-,16-/m0/s1