(3S,4R)-3-azanyl-4-oxidanyl-1-(phenylmethyl)azepan-2-one

Systemtic Name: (3S,4R)-3-azanyl-4-oxidanyl-1-(phenylmethyl)azepan-2-one Openeye Name: (3S,4R)-3-amino-1-benzyl-4-hydroxy-azepan-2-one CAS Name: (3S,4R)-3-amino-4-hydroxy-1-(phenylmethyl)-2-azepanone IUPAC Name: (3S,4R)-3-amino-1-benzyl-4-hydroxyazepan-2-one Traditional Name: (3S,4R)-3-amino-1-benzyl-4-hydroxy-azepan-2-one Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(=O)N(C1)CC2=CC=CC=C2)N)O

Isomeric SMILES

C1C[C@H]([C@@H](C(=O)N(C1)CC2=CC=CC=C2)N)O

InChI

InChI=1S/C13H18N2O2/c14-12-11(16)7-4-8-15(13(12)17)9-10-5-2-1-3-6-10/h1-3,5-6,11-12,16H,4,7-9,14H2/t11-,12+/m1/s1