4-[(2Z)-2-[cyano-(4-oxidanylidene-1H-quinazolin-2-yl)methylidene]hydrazinyl]benzoate

Systemtic Name: 4-[(2Z)-2-[cyano-(4-oxidanylidene-1H-quinazolin-2-yl)methylidene]hydrazinyl]benzoate Openeye Name: 4-[(2Z)-2-[cyano-(4-oxo-1H-quinazolin-2-yl)methylene]hydrazino]benzoate CAS Name: 4-[(2Z)-2-[cyano-(4-oxo-1H-quinazolin-2-yl)methylidene]hydrazinyl]benzoate IUPAC Name: 4-[(2Z)-2-[cyano-(4-oxo-1H-quinazolin-2-yl)methylidene]hydrazinyl]benzoate Traditional Name: 4-[(N'Z)-N'-[cyano-(4-keto-1H-quinazolin-2-yl)methylene]hydrazino]benzoate Formula: C17H10N5O3- MolecularWeight: 332.293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=NNC3=CC=C(C=C3)C(=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)/C(=N\NC3=CC=C(C=C3)C(=O)[O-])/C#N

InChI

InChI=1S/C17H11N5O3/c18-9-14(22-21-11-7-5-10(6-8-11)17(24)25)15-19-13-4-2-1-3-12(13)16(23)20-15/h1-8,21H,(H,24,25)(H,19,20,23)/p-1/b22-14-