3-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-4-oxo-chromen-2-olate CAS Name: 3-[(4-ethoxycarbonyl-1-piperidin-1-iumyl)methyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[(4-ethoxycarbonylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-2-olate Traditional Name: 3-[(4-carbethoxypiperidin-1-ium-1-yl)methyl]-4-keto-chromen-2-olate Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C18H21NO5/c1-2-23-17(21)12-7-9-19(10-8-12)11-14-16(20)13-5-3-4-6-15(13)24-18(14)22/h3-6,12,22H,2,7-11H2,1H3