2-(3-azanyl-2-oxidanylidene-azepan-1-yl)-3-phenyl-propanoic acid

Systemtic Name: 2-(3-azanyl-2-oxidanylidene-azepan-1-yl)-3-phenyl-propanoic acid Openeye Name: 2-(3-amino-2-oxo-azepan-1-yl)-3-phenyl-propanoic acid CAS Name: 2-(3-amino-2-oxo-1-azepanyl)-3-phenylpropanoic acid IUPAC Name: 2-(3-amino-2-oxoazepan-1-yl)-3-phenylpropanoic acid Traditional Name: 2-(3-amino-2-keto-azepan-1-yl)-3-phenyl-propionic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3/c16-12-8-4-5-9-17(14(12)18)13(15(19)20)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,16H2,(H,19,20)