8-methyl-7-oxidanyl-4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]chromen-2-one Openeye Name: 7-hydroxy-4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-8-methyl-chromen-2-one CAS Name: 7-hydroxy-4-[(4-hydroxy-1-piperidin-1-iumyl)methyl]-8-methyl-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-8-methylchromen-2-one Traditional Name: 7-hydroxy-4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-8-methyl-coumarin Formula: C16H20NO4+ MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+]3CCC(CC3)O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+]3CCC(CC3)O)O

InChI

InChI=1S/C16H19NO4/c1-10-14(19)3-2-13-11(8-15(20)21-16(10)13)9-17-6-4-12(18)5-7-17/h2-3,8,12,18-19H,4-7,9H2,1H3/p+1