[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl] (2S)-azepane-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl] (2S)-azepane-2-carboxylate Openeye Name: [(1R)-2-benzyloxy-1-methyl-2-oxo-ethyl] (2S)-azepane-2-carboxylate CAS Name: (2S)-2-azepanecarboxylic acid [(2R)-1-oxo-1-phenylmethoxypropan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-phenylmethoxypropan-2-yl] (2S)-azepane-2-carboxylate Traditional Name: (2S)-azepane-2-carboxylic acid [(1R)-2-benzoxy-2-keto-1-methyl-ethyl] ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)OC(=O)C2CCCCCN2

Isomeric SMILES

C[C@H](C(=O)OCC1=CC=CC=C1)OC(=O)[C@@H]2CCCCCN2

InChI

InChI=1S/C17H23NO4/c1-13(16(19)21-12-14-8-4-2-5-9-14)22-17(20)15-10-6-3-7-11-18-15/h2,4-5,8-9,13,15,18H,3,6-7,10-12H2,1H3/t13-,15+/m1/s1