3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(4-methoxy-3-nitro-phenyl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-keto-2-(4-methoxy-3-nitro-phenyl)ethyl]-1,2,3-benzotriazin-4-one Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3N=N2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3N=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5/c1-25-15-7-6-10(8-13(15)20(23)24)14(21)9-19-16(22)11-4-2-3-5-12(11)17-18-19/h2-8H,9H2,1H3