N-(3-morpholin-4-ium-4-ylpropyl)-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Formula: C20H24N5O3+ MolecularWeight: 382.43626

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C20H23N5O3/c26-19(21-8-3-9-24-12-14-27-15-13-24)20-22-18(23-28-20)16-4-6-17(7-5-16)25-10-1-2-11-25/h1-2,4-7,10-11H,3,8-9,12-15H2,(H,21,26)/p+1