(2S)-2-acetamido-7-oxidanylidene-7-phenylmethoxy-heptanoic acid

Systemtic Name: (2S)-2-acetamido-7-oxidanylidene-7-phenylmethoxy-heptanoic acid Openeye Name: (2S)-2-acetamido-7-benzyloxy-7-oxo-heptanoic acid CAS Name: (2S)-2-acetamido-7-oxo-7-phenylmethoxyheptanoic acid IUPAC Name: (2S)-2-acetamido-7-oxo-7-phenylmethoxyheptanoic acid Traditional Name: (2S)-2-acetamido-7-benzoxy-7-keto-enanthic acid Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CCCCC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H21NO5/c1-12(18)17-14(16(20)21)9-5-6-10-15(19)22-11-13-7-3-2-4-8-13/h2-4,7-8,14H,5-6,9-11H2,1H3,(H,17,18)(H,20,21)/t14-/m0/s1