5-[(5-azanyl-1-phenyl-1,2,4-triazol-3-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(5-azanyl-1-phenyl-1,2,4-triazol-3-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-5-oxo-pentanoic acid CAS Name: 5-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-5-oxopentanoic acid IUPAC Name: 5-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-5-keto-valeric acid Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)NC(=O)CCCC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)NC(=O)CCCC(=O)O)N

InChI

InChI=1S/C13H15N5O3/c14-12-16-13(15-10(19)7-4-8-11(20)21)17-18(12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,20,21)(H3,14,15,16,17,19)