3-(2-ethoxyphenoxy)-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-chromen-7-olate

Systemtic Name: 3-(2-ethoxyphenoxy)-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-chromen-7-olate Openeye Name: 3-(2-ethoxyphenoxy)-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxo-chromen-7-olate CAS Name: 3-(2-ethoxyphenoxy)-8-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-oxo-1-benzopyran-7-olate IUPAC Name: 3-(2-ethoxyphenoxy)-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-7-olate Traditional Name: 3-(2-ethoxyphenoxy)-4-keto-8-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-7-olate Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3C[NH+]4CCC(CC4)C)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3C[NH+]4CCC(CC4)C)[O-]

InChI

InChI=1S/C24H27NO5/c1-3-28-20-6-4-5-7-21(20)30-22-15-29-24-17(23(22)27)8-9-19(26)18(24)14-25-12-10-16(2)11-13-25/h4-9,15-16,26H,3,10-14H2,1-2H3