N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]-4-methyl-3-nitrobenzamide Traditional Name: 4-methyl-N-(6-methyl-2-p-phenetyl-benzotriazol-5-yl)-3-nitro-benzamide Formula: C23H21N5O4 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O4/c1-4-32-18-9-7-17(8-10-18)27-25-20-11-15(3)19(13-21(20)26-27)24-23(29)16-6-5-14(2)22(12-16)28(30)31/h5-13H,4H2,1-3H3,(H,24,29)