[1-[(6-oxidanyl-2,3-dihydro-1H-inden-5-yl)methyl]piperidin-1-ium-4-yl]-phenyl-methanone

Systemtic Name: [1-[(6-oxidanyl-2,3-dihydro-1H-inden-5-yl)methyl]piperidin-1-ium-4-yl]-phenyl-methanone Openeye Name: [1-[(6-hydroxyindan-5-yl)methyl]piperidin-1-ium-4-yl]-phenyl-methanone CAS Name: [1-[(6-hydroxy-2,3-dihydro-1H-inden-5-yl)methyl]-4-piperidin-1-iumyl]-phenylmethanone IUPAC Name: [1-[(6-hydroxy-2,3-dihydro-1H-inden-5-yl)methyl]piperidin-1-ium-4-yl]-phenylmethanone Traditional Name: [1-[(6-hydroxyindan-5-yl)methyl]piperidin-1-ium-4-yl]-phenyl-methanone Formula: C22H26NO2+ MolecularWeight: 336.44734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CCC(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CCC(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H25NO2/c24-21-14-19-8-4-7-18(19)13-20(21)15-23-11-9-17(10-12-23)22(25)16-5-2-1-3-6-16/h1-3,5-6,13-14,17,24H,4,7-12,15H2/p+1