8-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 8-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 8-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-[[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 8-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 8-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxy-4-methyl-coumarin Formula: C17H22NO4+ MolecularWeight: 304.36088

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC2=C(C=CC3=C2OC(=O)C=C3C)O

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CC2=C(C=CC3=C2OC(=O)C=C3C)O

InChI

InChI=1S/C17H21NO4/c1-10-6-16(20)22-17-13(10)4-5-15(19)14(17)9-18-7-11(2)21-12(3)8-18/h4-6,11-12,19H,7-9H2,1-3H3/p+1/t11-,12-/m0/s1