(2S)-4-azanyl-4-oxidanylidene-2-(quinolin-2-ylmethylamino)butanoic acid

Systemtic Name: (2S)-4-azanyl-4-oxidanylidene-2-(quinolin-2-ylmethylamino)butanoic acid Openeye Name: (2S)-4-amino-4-oxo-2-(2-quinolylmethylamino)butanoic acid CAS Name: (2S)-4-amino-4-oxo-2-(2-quinolinylmethylamino)butanoic acid IUPAC Name: (2S)-4-amino-4-oxo-2-(quinolin-2-ylmethylamino)butanoic acid Traditional Name: (2S)-4-amino-4-keto-2-(2-quinolylmethylamino)butyric acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CNC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CN[C@@H](CC(=O)N)C(=O)O

InChI

InChI=1S/C14H15N3O3/c15-13(18)7-12(14(19)20)16-8-10-6-5-9-3-1-2-4-11(9)17-10/h1-6,12,16H,7-8H2,(H2,15,18)(H,19,20)/t12-/m0/s1