3-[3-(3-azanyl-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propanoic acid

Systemtic Name: 3-[3-(3-azanyl-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propanoic acid Openeye Name: 3-[3-(3-amino-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propanoic acid CAS Name: 3-[3-(3-amino-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propanoic acid IUPAC Name: 3-[3-(3-amino-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propanoic acid Traditional Name: 3-[3-(3-amino-1,2,4-triazol-1-yl)phenyl]-2-(methylamino)propionic acid Formula: C12H15N5O2 MolecularWeight: 261.2798

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC(=CC=C1)N2C=NC(=N2)N)C(=O)O

Isomeric SMILES

CNC(CC1=CC(=CC=C1)N2C=NC(=N2)N)C(=O)O

InChI

InChI=1S/C12H15N5O2/c1-14-10(11(18)19)6-8-3-2-4-9(5-8)17-7-15-12(13)16-17/h2-5,7,10,14H,6H2,1H3,(H2,13,16)(H,18,19)