6-[[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one

Systemtic Name: 6-[[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Openeye Name: 6-[[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one CAS Name: 6-[[(2R,6R)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one IUPAC Name: 6-[[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Traditional Name: 6-[[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Formula: C20H26NO3+ MolecularWeight: 328.42534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O)C

Isomeric SMILES

C[C@@H]1CCC[C@H]([NH+]1CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O)C

InChI

InChI=1S/C20H25NO3/c1-12-5-3-6-13(2)21(12)11-17-18(22)10-9-15-14-7-4-8-16(14)20(23)24-19(15)17/h9-10,12-13,22H,3-8,11H2,1-2H3/p+1/t12-,13-/m1/s1