3-[(4-imidazol-1-ylphenyl)methylamino]propanoic acid

Systemtic Name: 3-[(4-imidazol-1-ylphenyl)methylamino]propanoic acid Openeye Name: 3-[(4-imidazol-1-ylphenyl)methylamino]propanoic acid CAS Name: 3-[[4-(1-imidazolyl)phenyl]methylamino]propanoic acid IUPAC Name: 3-[(4-imidazol-1-ylphenyl)methylamino]propanoic acid Traditional Name: 3-[(4-imidazol-1-ylbenzyl)amino]propionic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCCC(=O)O)N2C=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CNCCC(=O)O)N2C=CN=C2

InChI

InChI=1S/C13H15N3O2/c17-13(18)5-6-14-9-11-1-3-12(4-2-11)16-8-7-15-10-16/h1-4,7-8,10,14H,5-6,9H2,(H,17,18)