N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]benzotriazole-5-carboxamide

Systemtic Name: N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]benzotriazole-5-carboxamide Openeye Name: N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]benzotriazole-5-carboxamide CAS Name: N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-benzotriazolecarboxamide IUPAC Name: N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]benzotriazole-5-carboxamide Traditional Name: N-cyclopropyl-1-ethyl-N-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl]benzotriazole-5-carboxamide Formula: C21H19N7O4 MolecularWeight: 433.42006

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N(CC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C5CC5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N(CC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C5CC5)N=N1

InChI

InChI=1S/C21H19N7O4/c1-2-27-18-9-6-14(11-17(18)22-25-27)21(29)26(15-7-8-15)12-19-23-24-20(32-19)13-4-3-5-16(10-13)28(30)31/h3-6,9-11,15H,2,7-8,12H2,1H3