7-methoxy-2-(phenylmethyl)-4,1,2-benzoxadiazin-2-ium-3-one

Systemtic Name: 7-methoxy-2-(phenylmethyl)-4,1,2-benzoxadiazin-2-ium-3-one Openeye Name: 2-benzyl-7-methoxy-4,1,2-benzoxadiazin-2-ium-3-one CAS Name: 7-methoxy-2-(phenylmethyl)-4,1,2-benzoxadiazin-2-ium-3-one IUPAC Name: 2-benzyl-7-methoxy-4,1,2-benzoxadiazin-2-ium-3-one Traditional Name: 2-benzyl-7-methoxy-4,1,2-benzoxadiazin-2-ium-3-one Formula: C15H13N2O3+ MolecularWeight: 269.27532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)[N+](=N2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)[N+](=N2)CC3=CC=CC=C3

InChI

InChI=1S/C15H13N2O3/c1-19-12-7-8-14-13(9-12)16-17(15(18)20-14)10-11-5-3-2-4-6-11/h2-9H,10H2,1H3/q+1