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

Systemtic Name: 6-chloranyl-4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-chloro-4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxy-chromen-2-one CAS Name: 6-chloro-4-[[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxychromen-2-one Traditional Name: 6-chloro-4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-7-hydroxy-coumarin Formula: C16H19ClNO4+ MolecularWeight: 324.77936

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

InChI

InChI=1S/C16H18ClNO4/c1-9-6-18(7-10(2)21-9)8-11-3-16(20)22-15-5-14(19)13(17)4-12(11)15/h3-5,9-10,19H,6-8H2,1-2H3/p+1/t9-,10-/m1/s1