8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-chromen-2-one

Systemtic Name: 8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-chromen-2-one Openeye Name: 8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-(8-methoxy-2-oxo-chromen-3-yl)chromen-2-one CAS Name: 8-[[(2R)-2-ethyl-1-piperidin-1-iumyl]methyl]-7-hydroxy-4-(8-methoxy-2-oxo-1-benzopyran-3-yl)-1-benzopyran-2-one IUPAC Name: 8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-(8-methoxy-2-oxochromen-3-yl)chromen-2-one Traditional Name: 8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-(2-keto-8-methoxy-chromen-3-yl)coumarin Formula: C27H28NO6+ MolecularWeight: 462.51432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)O

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)O

InChI

InChI=1S/C27H27NO6/c1-3-17-8-4-5-12-28(17)15-21-22(29)11-10-18-19(14-24(30)33-26(18)21)20-13-16-7-6-9-23(32-2)25(16)34-27(20)31/h6-7,9-11,13-14,17,29H,3-5,8,12,15H2,1-2H3/p+1/t17-/m1/s1