3,4-dimethoxy-N-[2-(3-nitrophenyl)benzotriazol-5-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[2-(3-nitrophenyl)benzotriazol-5-yl]benzamide Openeye Name: 3,4-dimethoxy-N-[2-(3-nitrophenyl)benzotriazol-5-yl]benzamide CAS Name: 3,4-dimethoxy-N-[2-(3-nitrophenyl)-5-benzotriazolyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[2-(3-nitrophenyl)benzotriazol-5-yl]benzamide Traditional Name: 3,4-dimethoxy-N-[2-(3-nitrophenyl)benzotriazol-5-yl]benzamide Formula: C21H17N5O5 MolecularWeight: 419.39018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C21H17N5O5/c1-30-19-9-6-13(10-20(19)31-2)21(27)22-14-7-8-17-18(11-14)24-25(23-17)15-4-3-5-16(12-15)26(28)29/h3-12H,1-2H3,(H,22,27)