1',1'-bis(phenylmethyl)spiro[3H-chromene-2,4'-piperidin-1-ium]-4-one

Systemtic Name: 1',1'-bis(phenylmethyl)spiro[3H-chromene-2,4'-piperidin-1-ium]-4-one Openeye Name: 1',1'-dibenzylspiro[chromane-2,4'-piperidin-1-ium]-4-one CAS Name: 1',1'-bis(phenylmethyl)-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidin-1-ium]one IUPAC Name: 1',1'-dibenzylspiro[3H-chromene-2,4'-piperidin-1-ium]-4-one Traditional Name: 1',1'-dibenzylspiro[chroman-2,4'-piperidin-1-ium]-4-one Formula: C27H28NO2+ MolecularWeight: 398.51672

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCC12CC(=O)C3=CC=CC=C3O2)(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C[N+](CCC12CC(=O)C3=CC=CC=C3O2)(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H28NO2/c29-25-19-27(30-26-14-8-7-13-24(25)26)15-17-28(18-16-27,20-22-9-3-1-4-10-22)21-23-11-5-2-6-12-23/h1-14H,15-21H2/q+1