2-bromanyl-N-[2-(4-methoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide

Systemtic Name: 2-bromanyl-N-[2-(4-methoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide Openeye Name: 2-bromo-N-[2-(4-methoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide CAS Name: 2-bromo-N-[2-(4-methoxyphenyl)-5-benzotriazolyl]-5-nitrobenzamide IUPAC Name: 2-bromo-N-[2-(4-methoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide Traditional Name: 2-bromo-N-[2-(4-methoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide Formula: C20H14BrN5O4 MolecularWeight: 468.26026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C20H14BrN5O4/c1-30-15-6-3-13(4-7-15)25-23-18-9-2-12(10-19(18)24-25)22-20(27)16-11-14(26(28)29)5-8-17(16)21/h2-11H,1H3,(H,22,27)