(3S)-3-azanyl-1-(phenylmethyl)azepan-2-one

Systemtic Name: (3S)-3-azanyl-1-(phenylmethyl)azepan-2-one Openeye Name: (3S)-3-amino-1-benzyl-azepan-2-one CAS Name: (3S)-3-amino-1-(phenylmethyl)-2-azepanone IUPAC Name: (3S)-3-amino-1-benzylazepan-2-one Traditional Name: (3S)-3-amino-1-benzyl-azepan-2-one Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)N)CC2=CC=CC=C2

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)N)CC2=CC=CC=C2

InChI

InChI=1S/C13H18N2O/c14-12-8-4-5-9-15(13(12)16)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,14H2/t12-/m0/s1