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

Systemtic Name: N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-nitro-benzamide Openeye Name: N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-nitro-benzamide CAS Name: N-[2-(4-methoxyphenyl)-6-methyl-5-benzotriazolyl]-2-nitrobenzamide IUPAC Name: N-[2-(4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-2-nitrobenzamide Traditional Name: N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]-2-nitro-benzamide Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC=CC=C3[N+](=O)[O-])C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC=CC=C3[N+](=O)[O-])C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H17N5O4/c1-13-11-18-19(24-25(23-18)14-7-9-15(30-2)10-8-14)12-17(13)22-21(27)16-5-3-4-6-20(16)26(28)29/h3-12H,1-2H3,(H,22,27)