4-methyl-7-[(2R)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-oxidanyl-propoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[(2R)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-oxidanyl-propoxy]chromen-2-one Openeye Name: 7-[(2R)-2-hydroxy-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]-4-methyl-chromen-2-one CAS Name: 7-[(2R)-2-hydroxy-3-[(3S)-3-methyl-1-piperidin-1-iumyl]propoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[(2R)-2-hydroxy-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]-4-methylchromen-2-one Traditional Name: 7-[(2R)-2-hydroxy-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]-4-methyl-coumarin Formula: C19H26NO4+ MolecularWeight: 332.41404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C[C@H](COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O

InChI

InChI=1S/C19H25NO4/c1-13-4-3-7-20(10-13)11-15(21)12-23-16-5-6-17-14(2)8-19(22)24-18(17)9-16/h5-6,8-9,13,15,21H,3-4,7,10-12H2,1-2H3/p+1/t13-,15+/m0/s1