tert-butyl (2S)-2-[[(4R,5S)-4-heptyl-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: tert-butyl (2S)-2-[[(4R,5S)-4-heptyl-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: tert-butyl (2S)-2-[[(4R,5S)-4-heptyl-2-oxo-oxazolidine-5-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[(4R,5S)-4-heptyl-2-oxo-5-oxazolidinyl]-oxomethyl]amino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(4R,5S)-4-heptyl-2-oxo-1,3-oxazolidine-5-carbonyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(4R,5S)-4-heptyl-2-keto-oxazolidine-5-carbonyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C21H38N2O5 MolecularWeight: 398.53682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(OC(=O)N1)C(=O)NC(CC(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC[C@@H]1[C@H](OC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H38N2O5/c1-7-8-9-10-11-12-15-17(27-20(26)23-15)18(24)22-16(13-14(2)3)19(25)28-21(4,5)6/h14-17H,7-13H2,1-6H3,(H,22,24)(H,23,26)/t15-,16+,17+/m1/s1