(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate; [4-(phenylcarbamoyl)-1H-pyrazol-5-yl]azanium

Systemtic Name: (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate; [4-(phenylcarbamoyl)-1H-pyrazol-5-yl]azanium Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; [4-(phenylcarbamoyl)-1H-pyrazol-5-yl]ammonium CAS Name: [4-[anilino(oxo)methyl]-1H-pyrazol-5-yl]ammonium; (Z)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; [4-(phenylcarbamoyl)-1H-pyrazol-5-yl]azanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; [4-(phenylcarbamoyl)-1H-pyrazol-5-yl]ammonium Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C(NN=C2)[NH3+].C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C(NN=C2)[NH3+].C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C10H10N4O.C4H4O4/c11-9-8(6-12-14-9)10(15)13-7-4-2-1-3-5-7;5-3(6)1-2-4(7)8/h1-6H,(H,13,15)(H3,11,12,14);1-2H,(H,5,6)(H,7,8)/b;2-1-