(3S)-3-azanyl-1-phenylmethoxy-azepan-2-one hydrobromide

Systemtic Name: (3S)-3-azanyl-1-phenylmethoxy-azepan-2-one hydrobromide Openeye Name: (3S)-3-amino-1-benzyloxy-azepan-2-one hydrobromide CAS Name: (3S)-3-amino-1-phenylmethoxy-2-azepanone hydrobromide IUPAC Name: (3S)-3-amino-1-phenylmethoxyazepan-2-one hydrobromide Traditional Name: (3S)-3-amino-1-benzoxy-azepan-2-one hydrobromide Formula: C13H19BrN2O2 MolecularWeight: 315.20616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)N)OCC2=CC=CC=C2.Br

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)N)OCC2=CC=CC=C2.Br

InChI

InChI=1S/C13H18N2O2.BrH/c14-12-8-4-5-9-15(13(12)16)17-10-11-6-2-1-3-7-11;/h1-3,6-7,12H,4-5,8-10,14H2;1H/t12-;/m0./s1