4-(6-chloranyl-3-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylcarbonyl-indol-1-yl)butanenitrile

Systemtic Name: 4-(6-chloranyl-3-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylcarbonyl-indol-1-yl)butanenitrile Openeye Name: 4-[6-chloro-3-(spiro[1H-isobenzofuran-3,4'-piperidine]-1'-carbonyl)indol-1-yl]butanenitrile CAS Name: 4-[6-chloro-3-[oxo(1'-spiro[1H-isobenzofuran-3,4'-piperidine]yl)methyl]-1-indolyl]butanenitrile IUPAC Name: 4-[6-chloro-3-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)indol-1-yl]butanenitrile Traditional Name: 4-[6-chloro-3-(spiro[phthalan-1,4'-piperidine]-1'-carbonyl)indol-1-yl]butyronitrile Formula: C25H24ClN3O2 MolecularWeight: 433.92996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C3=CC=CC=C3CO2)C(=O)C4=CN(C5=C4C=CC(=C5)Cl)CCCC#N

Isomeric SMILES

C1CN(CCC12C3=CC=CC=C3CO2)C(=O)C4=CN(C5=C4C=CC(=C5)Cl)CCCC#N

InChI

InChI=1S/C25H24ClN3O2/c26-19-7-8-20-21(16-29(23(20)15-19)12-4-3-11-27)24(30)28-13-9-25(10-14-28)22-6-2-1-5-18(22)17-31-25/h1-2,5-8,15-16H,3-4,9-10,12-14,17H2