N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-(4-ethoxyphenyl)-5-benzotriazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-2-methyl-3-nitrobenzamide Traditional Name: 2-methyl-3-nitro-N-(2-p-phenetylbenzotriazol-5-yl)benzamide Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H19N5O4/c1-3-31-17-10-8-16(9-11-17)26-24-19-12-7-15(13-20(19)25-26)23-22(28)18-5-4-6-21(14(18)2)27(29)30/h4-13H,3H2,1-2H3,(H,23,28)