4-[(2-azanylquinolin-6-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylic acid

Systemtic Name: 4-[(2-azanylquinolin-6-yl)methyl]-3-oxidanylidene-piperazine-1-carboxylic acid Openeye Name: 4-[(2-amino-6-quinolyl)methyl]-3-oxo-piperazine-1-carboxylic acid CAS Name: 4-[(2-amino-6-quinolinyl)methyl]-3-oxo-1-piperazinecarboxylic acid IUPAC Name: 4-[(2-aminoquinolin-6-yl)methyl]-3-oxopiperazine-1-carboxylic acid Traditional Name: 4-[(2-amino-6-quinolyl)methyl]-3-keto-piperazine-1-carboxylic acid Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)O)CC2=CC3=C(C=C2)N=C(C=C3)N

Isomeric SMILES

C1CN(C(=O)CN1C(=O)O)CC2=CC3=C(C=C2)N=C(C=C3)N

InChI

InChI=1S/C15H16N4O3/c16-13-4-2-11-7-10(1-3-12(11)17-13)8-18-5-6-19(15(21)22)9-14(18)20/h1-4,7H,5-6,8-9H2,(H2,16,17)(H,21,22)