3-oxidanylidene-3-phenyl-2-(2H-1,2,3,4-tetrazol-5-ylmethyl)propanal

Systemtic Name: 3-oxidanylidene-3-phenyl-2-(2H-1,2,3,4-tetrazol-5-ylmethyl)propanal Openeye Name: 3-oxo-3-phenyl-2-(2H-tetrazol-5-ylmethyl)propanal CAS Name: 3-oxo-3-phenyl-2-(2H-tetrazol-5-ylmethyl)propanal IUPAC Name: 3-oxo-3-phenyl-2-(2H-tetrazol-5-ylmethyl)propanal Traditional Name: 3-keto-3-phenyl-2-(2H-tetrazol-5-ylmethyl)propionaldehyde Formula: C11H10N4O2 MolecularWeight: 230.2227

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(CC2=NNN=N2)C=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(CC2=NNN=N2)C=O

InChI

InChI=1S/C11H10N4O2/c16-7-9(6-10-12-14-15-13-10)11(17)8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,12,13,14,15)