4-[2-[4-oxidanyl-6-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]hydrazinyl]benzoate

Systemtic Name: 4-[2-[4-oxidanyl-6-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]hydrazinyl]benzoate Openeye Name: 4-[2-(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)hydrazino]benzoate CAS Name: 4-[[4-hydroxy-6-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]hydrazo]benzoate IUPAC Name: 4-[2-(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)hydrazinyl]benzoate Traditional Name: 4-[N'-(5-benzyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)hydrazino]benzoate Formula: C18H15N4O4- MolecularWeight: 351.3361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C(NC2=O)NNC3=CC=C(C=C3)C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C(NC2=O)NNC3=CC=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C18H16N4O4/c23-15-14(10-11-4-2-1-3-5-11)16(24)20-18(19-15)22-21-13-8-6-12(7-9-13)17(25)26/h1-9,21H,10H2,(H,25,26)(H3,19,20,22,23,24)/p-1