1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one

Systemtic Name: 1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one Openeye Name: 1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)spiro[isobenzofuran-3,4'-piperidine]-1-one CAS Name: 1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1-spiro[isobenzofuran-3,4'-piperidine]one IUPAC Name: 1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)spiro[2-benzofuran-3,4'-piperidine]-1-one Traditional Name: 1'-(5,6-dimethoxy-1H-benzimidazol-2-yl)spiro[phthalan-3,4'-piperidine]-1-one Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)NC(=N2)N3CCC4(CC3)C5=CC=CC=C5C(=O)O4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)NC(=N2)N3CCC4(CC3)C5=CC=CC=C5C(=O)O4)OC

InChI

InChI=1S/C21H21N3O4/c1-26-17-11-15-16(12-18(17)27-2)23-20(22-15)24-9-7-21(8-10-24)14-6-4-3-5-13(14)19(25)28-21/h3-6,11-12H,7-10H2,1-2H3,(H,22,23)