methyl (2S)-2-[[(2S)-2-(decanoylamino)propanoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-(decanoylamino)propanoyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(decanoylamino)propanoyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-3-hydroxy-2-[[(2S)-1-oxo-2-(1-oxodecylamino)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-(decanoylamino)propanoyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(2S)-2-(caprylamino)propanoyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C17H32N2O5 MolecularWeight: 344.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(C)C(=O)NC(CO)C(=O)OC

Isomeric SMILES

CCCCCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)OC

InChI

InChI=1S/C17H32N2O5/c1-4-5-6-7-8-9-10-11-15(21)18-13(2)16(22)19-14(12-20)17(23)24-3/h13-14,20H,4-12H2,1-3H3,(H,18,21)(H,19,22)/t13-,14-/m0/s1