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

Systemtic Name: N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]-4-nitro-benzamide Openeye Name: N-[2-(4-isopropylphenyl)-6-methyl-benzotriazol-5-yl]-4-nitro-benzamide CAS Name: N-[6-methyl-2-(4-propan-2-ylphenyl)-5-benzotriazolyl]-4-nitrobenzamide IUPAC Name: N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]-4-nitrobenzamide Traditional Name: N-(6-methyl-2-p-cumenyl-benzotriazol-5-yl)-4-nitro-benzamide Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O3/c1-14(2)16-4-8-18(9-5-16)27-25-21-12-15(3)20(13-22(21)26-27)24-23(29)17-6-10-19(11-7-17)28(30)31/h4-14H,1-3H3,(H,24,29)