N-(2-oxidanylideneazepan-3-yl)-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-oxoazepan-3-yl)-2-phenyl-triazole-4-carboxamide CAS Name: N-(2-oxo-3-azepanyl)-2-phenyl-4-triazolecarboxamide IUPAC Name: N-(2-oxoazepan-3-yl)-2-phenyltriazole-4-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-2-phenyl-triazole-4-carboxamide Formula: C15H17N5O2 MolecularWeight: 299.32778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C15H17N5O2/c21-14-12(8-4-5-9-16-14)18-15(22)13-10-17-20(19-13)11-6-2-1-3-7-11/h1-3,6-7,10,12H,4-5,8-9H2,(H,16,21)(H,18,22)