3-oxidanylidene-N-(1-phenylpyrazol-4-yl)spiro[2-benzofuran-1,4'-piperidine]-1'-carboxamide

Systemtic Name: 3-oxidanylidene-N-(1-phenylpyrazol-4-yl)spiro[2-benzofuran-1,4'-piperidine]-1'-carboxamide Openeye Name: 3-oxo-N-(1-phenylpyrazol-4-yl)spiro[isobenzofuran-1,4'-piperidine]-1'-carboxamide CAS Name: 3-oxo-N-(1-phenyl-4-pyrazolyl)-1'-spiro[isobenzofuran-1,4'-piperidine]carboxamide IUPAC Name: 3-oxo-N-(1-phenylpyrazol-4-yl)spiro[2-benzofuran-1,4'-piperidine]-1'-carboxamide Traditional Name: 3-keto-N-(1-phenylpyrazol-4-yl)spiro[phthalan-1,4'-piperidine]-1'-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C3=CC=CC=C3C(=O)O2)C(=O)NC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC12C3=CC=CC=C3C(=O)O2)C(=O)NC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H20N4O3/c27-20-18-8-4-5-9-19(18)22(29-20)10-12-25(13-11-22)21(28)24-16-14-23-26(15-16)17-6-2-1-3-7-17/h1-9,14-15H,10-13H2,(H,24,28)