5-(4-nitrophenyl)-N-(4-pyrrolidin-1-ylbut-2-ynyl)-1,2,4-oxadiazole-3-carboxamide

Systemtic Name: 5-(4-nitrophenyl)-N-(4-pyrrolidin-1-ylbut-2-ynyl)-1,2,4-oxadiazole-3-carboxamide Openeye Name: 5-(4-nitrophenyl)-N-(4-pyrrolidin-1-ylbut-2-ynyl)-1,2,4-oxadiazole-3-carboxamide CAS Name: 5-(4-nitrophenyl)-N-[4-(1-pyrrolidinyl)but-2-ynyl]-1,2,4-oxadiazole-3-carboxamide IUPAC Name: 5-(4-nitrophenyl)-N-(4-pyrrolidin-1-ylbut-2-ynyl)-1,2,4-oxadiazole-3-carboxamide Traditional Name: 5-(4-nitrophenyl)-N-(4-pyrrolidinobut-2-ynyl)-1,2,4-oxadiazole-3-carboxamide Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CCNC(=O)C2=NOC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC#CCNC(=O)C2=NOC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c23-16(18-9-1-2-10-21-11-3-4-12-21)15-19-17(26-20-15)13-5-7-14(8-6-13)22(24)25/h5-8H,3-4,9-12H2,(H,18,23)