8-[(3,5-dimethylpiperidin-1-ium-1-yl)methyl]-4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-2-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[(3,5-dimethylpiperidin-1-ium-1-yl)methyl]-4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-2-oxidanylidene-chromen-7-olate Openeye Name: 8-[(3,5-dimethylpiperidin-1-ium-1-yl)methyl]-4-(8-methoxy-2-oxo-chromen-3-yl)-2-oxo-chromen-7-olate CAS Name: 8-[(3,5-dimethyl-1-piperidin-1-iumyl)methyl]-4-(8-methoxy-2-oxo-1-benzopyran-3-yl)-2-oxo-1-benzopyran-7-olate IUPAC Name: 8-[(3,5-dimethylpiperidin-1-ium-1-yl)methyl]-4-(8-methoxy-2-oxochromen-3-yl)-2-oxochromen-7-olate Traditional Name: 8-[(3,5-dimethylpiperidin-1-ium-1-yl)methyl]-2-keto-4-(2-keto-8-methoxy-chromen-3-yl)chromen-7-olate Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)[O-])C

Isomeric SMILES

CC1CC(C[NH+](C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)[O-])C

InChI

InChI=1S/C27H27NO6/c1-15-9-16(2)13-28(12-15)14-21-22(29)8-7-18-19(11-24(30)33-26(18)21)20-10-17-5-4-6-23(32-3)25(17)34-27(20)31/h4-8,10-11,15-16,29H,9,12-14H2,1-3H3