3-[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[5-(aminomethyl)spiro[2H-benzofuran-3,4'-piperidine]-1'-carbonyl]benzonitrile CAS Name: 3-[[5-(aminomethyl)-1'-spiro[2H-benzofuran-3,4'-piperidine]yl]-oxomethyl]benzonitrile IUPAC Name: 3-[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-carbonyl]benzonitrile Traditional Name: 3-[5-(aminomethyl)spiro[coumaran-3,4'-piperidine]-1'-carbonyl]benzonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12COC3=C2C=C(C=C3)CN)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC12COC3=C2C=C(C=C3)CN)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H21N3O2/c22-12-15-2-1-3-17(10-15)20(25)24-8-6-21(7-9-24)14-26-19-5-4-16(13-23)11-18(19)21/h1-5,10-11H,6-9,13-14,23H2