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

Systemtic Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxo-chromen-2-olate CAS Name: 3-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-oxochromen-2-olate Traditional Name: 4-keto-3-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-olate Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C16H19NO3/c1-11-6-8-17(9-7-11)10-13-15(18)12-4-2-3-5-14(12)20-16(13)19/h2-5,11,19H,6-10H2,1H3