(phenylmethyl) (2S,3R)-3-azanyl-3-cycloheptyl-2-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) (2S,3R)-3-azanyl-3-cycloheptyl-2-oxidanyl-propanoate Openeye Name: benzyl (2S,3R)-3-amino-3-cycloheptyl-2-hydroxy-propanoate CAS Name: (2S,3R)-3-amino-3-cycloheptyl-2-hydroxypropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-amino-3-cycloheptyl-2-hydroxypropanoate Traditional Name: (2S,3R)-3-amino-3-cycloheptyl-2-hydroxy-propionic acid benzyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(C(C(=O)OCC2=CC=CC=C2)O)N

Isomeric SMILES

C1CCCC(CC1)[C@H]([C@@H](C(=O)OCC2=CC=CC=C2)O)N

InChI

InChI=1S/C17H25NO3/c18-15(14-10-6-1-2-7-11-14)16(19)17(20)21-12-13-8-4-3-5-9-13/h3-5,8-9,14-16,19H,1-2,6-7,10-12,18H2/t15-,16+/m1/s1