7-methyl-4-[(2-methylpiperidin-1-ium-1-yl)methyl]-2-oxidanylidene-chromen-6-olate

Systemtic Name: 7-methyl-4-[(2-methylpiperidin-1-ium-1-yl)methyl]-2-oxidanylidene-chromen-6-olate Openeye Name: 7-methyl-4-[(2-methylpiperidin-1-ium-1-yl)methyl]-2-oxo-chromen-6-olate CAS Name: 7-methyl-4-[(2-methyl-1-piperidin-1-iumyl)methyl]-2-oxo-1-benzopyran-6-olate IUPAC Name: 7-methyl-4-[(2-methylpiperidin-1-ium-1-yl)methyl]-2-oxochromen-6-olate Traditional Name: 2-keto-7-methyl-4-[(2-methylpiperidin-1-ium-1-yl)methyl]chromen-6-olate Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

Isomeric SMILES

CC1CCCC[NH+]1CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C

InChI

InChI=1S/C17H21NO3/c1-11-7-16-14(9-15(11)19)13(8-17(20)21-16)10-18-6-4-3-5-12(18)2/h7-9,12,19H,3-6,10H2,1-2H3