5-(2-azanylethyl)-1H-imidazole-4-carboxamide; (2S)-2-azanyl-3-(4-fluorophenyl)propanoic acid

Systemtic Name: 5-(2-azanylethyl)-1H-imidazole-4-carboxamide; (2S)-2-azanyl-3-(4-fluorophenyl)propanoic acid Openeye Name: 5-(2-aminoethyl)-1H-imidazole-4-carboxamide; (2S)-2-amino-3-(4-fluorophenyl)propanoic acid CAS Name: 5-(2-aminoethyl)-1H-imidazole-4-carboxamide; (2S)-2-amino-3-(4-fluorophenyl)propanoic acid IUPAC Name: 5-(2-aminoethyl)-1H-imidazole-4-carboxamide; (2S)-2-amino-3-(4-fluorophenyl)propanoic acid Traditional Name: 5-(2-aminoethyl)-1H-imidazole-4-carboxamide; (2S)-2-amino-3-(4-fluorophenyl)propionic acid Formula: C15H20FN5O3 MolecularWeight: 337.349403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)F.C1=NC(=C(N1)CCN)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)O)N)F.C1=NC(=C(N1)CCN)C(=O)N

InChI

InChI=1S/C9H10FNO2.C6H10N4O/c10-7-3-1-6(2-4-7)5-8(11)9(12)13;7-2-1-4-5(6(8)11)10-3-9-4/h1-4,8H,5,11H2,(H,12,13);3H,1-2,7H2,(H2,8,11)(H,9,10)/t8-;/m0./s1