methyl (2S)-2-[[(4S)-4-acetyloxy-5-phenylmethoxy-pentanoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[(4S)-4-acetyloxy-5-phenylmethoxy-pentanoyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[[(4S)-4-acetoxy-5-benzyloxy-pentanoyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[(4S)-4-acetyloxy-1-oxo-5-phenylmethoxypentyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(4S)-4-acetyloxy-5-phenylmethoxypentanoyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(4S)-4-acetoxy-5-benzoxy-pentanoyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C18H25NO7 MolecularWeight: 367.3936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCC(=O)NC(CO)C(=O)OC)COCC1=CC=CC=C1

Isomeric SMILES

CC(=O)O[C@@H](CCC(=O)N[C@@H](CO)C(=O)OC)COCC1=CC=CC=C1

InChI

InChI=1S/C18H25NO7/c1-13(21)26-15(12-25-11-14-6-4-3-5-7-14)8-9-17(22)19-16(10-20)18(23)24-2/h3-7,15-16,20H,8-12H2,1-2H3,(H,19,22)/t15-,16-/m0/s1