6-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(5-phenyltetrazol-2-yl)acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(5-phenyltetrazol-2-yl)acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(5-phenyltetrazol-2-yl)acetyl]-4H-1,4-benzoxazin-3-one Formula: C17H13N5O3 MolecularWeight: 335.31682

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3N=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3N=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C17H13N5O3/c23-14(12-6-7-15-13(8-12)18-16(24)10-25-15)9-22-20-17(19-21-22)11-4-2-1-3-5-11/h1-8H,9-10H2,(H,18,24)