1-phenyl-1'-prop-2-ynyl-spiro[1H-2-benzofuran-3,4'-azepane]

Systemtic Name: 1-phenyl-1'-prop-2-ynyl-spiro[1H-2-benzofuran-3,4'-azepane] Openeye Name: 1-phenyl-1'-prop-2-ynyl-spiro[1H-isobenzofuran-3,4'-azepane] CAS Name: 1-phenyl-1'-prop-2-ynylspiro[1H-isobenzofuran-3,4'-azepane] IUPAC Name: 1-phenyl-1'-prop-2-ynylspiro[1H-2-benzofuran-3,4'-azepane] Traditional Name: 3'-phenyl-1-propargyl-spiro[azepane-4,1'-phthalan] Formula: C22H23NO MolecularWeight: 317.42412

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCCC2(CC1)C3=CC=CC=C3C(O2)C4=CC=CC=C4

Isomeric SMILES

C#CCN1CCCC2(CC1)C3=CC=CC=C3C(O2)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO/c1-2-15-23-16-8-13-22(14-17-23)20-12-7-6-11-19(20)21(24-22)18-9-4-3-5-10-18/h1,3-7,9-12,21H,8,13-17H2