(E)-3-(2-nitrophenyl)-1-(3-oxidanidylbenzotriazol-3-ium-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-nitrophenyl)-1-(3-oxidanidylbenzotriazol-3-ium-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(2-nitrophenyl)-1-(3-oxidobenzotriazol-3-ium-1-yl)prop-2-en-1-one CAS Name: (E)-3-(2-nitrophenyl)-1-(3-oxido-1-benzotriazol-3-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(2-nitrophenyl)-1-(3-oxidobenzotriazol-3-ium-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(2-nitrophenyl)-1-(3-oxidobenzotriazol-3-ium-1-yl)prop-2-en-1-one Formula: C15H10N4O4 MolecularWeight: 310.2643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)N2C3=CC=CC=C3[N+](=N2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)N2C3=CC=CC=C3[N+](=N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O4/c20-15(10-9-11-5-1-2-6-12(11)19(22)23)17-13-7-3-4-8-14(13)18(21)16-17/h1-10H/b10-9+