heptyl (2S)-2-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: heptyl (2S)-2-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-3-oxidanyl-propanoate Openeye Name: heptyl (2S)-2-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[(2S,3R)-2-amino-3-hydroxy-1-oxobutyl]amino]-3-hydroxypropanoic acid heptyl ester IUPAC Name: heptyl (2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-3-hydroxy-propionic acid heptyl ester Formula: C14H28N2O5 MolecularWeight: 304.38252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(CO)NC(=O)C(C(C)O)N

Isomeric SMILES

CCCCCCCOC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)N

InChI

InChI=1S/C14H28N2O5/c1-3-4-5-6-7-8-21-14(20)11(9-17)16-13(19)12(15)10(2)18/h10-12,17-18H,3-9,15H2,1-2H3,(H,16,19)/t10-,11+,12+/m1/s1