5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]methyl]-3-phenyl-1,2,4-oxadiazole Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=NC(=NO2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(N(C1)CC2=NC(=NO2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C22H23N3O3/c1-2-6-16(7-3-1)22-23-21(28-24-22)15-25-11-4-8-18(25)17-9-10-19-20(14-17)27-13-5-12-26-19/h1-3,6-7,9-10,14,18H,4-5,8,11-13,15H2