N-(4-iodophenyl)-1-methyl-benzotriazole-5-carboxamide

Systemtic Name: N-(4-iodophenyl)-1-methyl-benzotriazole-5-carboxamide Openeye Name: N-(4-iodophenyl)-1-methyl-benzotriazole-5-carboxamide CAS Name: N-(4-iodophenyl)-1-methyl-5-benzotriazolecarboxamide IUPAC Name: N-(4-iodophenyl)-1-methylbenzotriazole-5-carboxamide Traditional Name: N-(4-iodophenyl)-1-methyl-benzotriazole-5-carboxamide Formula: C14H11IN4O MolecularWeight: 378.16781

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)I)N=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)I)N=N1

InChI

InChI=1S/C14H11IN4O/c1-19-13-7-2-9(8-12(13)17-18-19)14(20)16-11-5-3-10(15)4-6-11/h2-8H,1H3,(H,16,20)