1,3-benzodioxol-5-yl-[3-(4-imidazol-1-ylphenoxy)pyrrolidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-(4-imidazol-1-ylphenoxy)pyrrolidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-(4-imidazol-1-ylphenoxy)pyrrolidin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-[4-(1-imidazolyl)phenoxy]-1-pyrrolidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-(4-imidazol-1-ylphenoxy)pyrrolidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-(4-imidazol-1-ylphenoxy)pyrrolidino]methanone Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1OC2=CC=C(C=C2)N3C=CN=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CC1OC2=CC=C(C=C2)N3C=CN=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O4/c25-21(15-1-6-19-20(11-15)27-14-26-19)23-9-7-18(12-23)28-17-4-2-16(3-5-17)24-10-8-22-13-24/h1-6,8,10-11,13,18H,7,9,12,14H2