5-chloranyl-N-(2-methyl-4-nitro-phenyl)benzotriazole-1-carboxamide

Systemtic Name: 5-chloranyl-N-(2-methyl-4-nitro-phenyl)benzotriazole-1-carboxamide Openeye Name: 5-chloro-N-(2-methyl-4-nitro-phenyl)benzotriazole-1-carboxamide CAS Name: 5-chloro-N-(2-methyl-4-nitrophenyl)-1-benzotriazolecarboxamide IUPAC Name: 5-chloro-N-(2-methyl-4-nitrophenyl)benzotriazole-1-carboxamide Traditional Name: 5-chloro-N-(2-methyl-4-nitro-phenyl)benzotriazole-1-carboxamide Formula: C14H10ClN5O3 MolecularWeight: 331.7139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)N2C3=C(C=C(C=C3)Cl)N=N2

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)N2C3=C(C=C(C=C3)Cl)N=N2

InChI

InChI=1S/C14H10ClN5O3/c1-8-6-10(20(22)23)3-4-11(8)16-14(21)19-13-5-2-9(15)7-12(13)17-18-19/h2-7H,1H3,(H,16,21)