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

Systemtic Name: 4-methyl-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxidanylidene-chromen-7-olate Openeye Name: 4-methyl-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxo-chromen-7-olate CAS Name: 4-methyl-8-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-oxo-1-benzopyran-7-olate IUPAC Name: 4-methyl-8-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxochromen-7-olate Traditional Name: 2-keto-4-methyl-8-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-7-olate Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=O)C=C3C)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=O)C=C3C)[O-]

InChI

InChI=1S/C17H21NO3/c1-11-5-7-18(8-6-11)10-14-15(19)4-3-13-12(2)9-16(20)21-17(13)14/h3-4,9,11,19H,5-8,10H2,1-2H3