(phenylmethyl) (2S)-2-azanyl-3-(2-oxidanylidenecyclohexyl)propanoate

Systemtic Name: (phenylmethyl) (2S)-2-azanyl-3-(2-oxidanylidenecyclohexyl)propanoate Openeye Name: benzyl (2S)-2-amino-3-(2-oxocyclohexyl)propanoate CAS Name: (2S)-2-amino-3-(2-oxocyclohexyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-amino-3-(2-oxocyclohexyl)propanoate Traditional Name: (2S)-2-amino-3-(2-ketocyclohexyl)propionic acid benzyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)CC(C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C1CCC(=O)C(C1)C[C@@H](C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C16H21NO3/c17-14(10-13-8-4-5-9-15(13)18)16(19)20-11-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,17H2/t13?,14-/m0/s1