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

Systemtic Name: (Z)-4-[(5-azanyl-1-phenyl-1,2,4-triazol-3-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)amino]-4-keto-but-2-enoic acid Formula: C12H11N5O3 MolecularWeight: 273.24744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)NC(=O)/C=C\C(=O)O)N

InChI

InChI=1S/C12H11N5O3/c13-11-15-12(14-9(18)6-7-10(19)20)16-17(11)8-4-2-1-3-5-8/h1-7H,(H,19,20)(H3,13,14,15,16,18)/b7-6-