(6-chloranyl-4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (6-chloranyl-4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (6-chloro-4-ethyl-7-hydroxy-2-oxo-chromen-8-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (6-chloro-4-ethyl-7-hydroxy-2-oxo-1-benzopyran-8-yl)methyl-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (6-chloro-4-ethyl-7-hydroxy-2-oxochromen-8-yl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: (6-chloro-4-ethyl-7-hydroxy-2-keto-chromen-8-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C17H21ClNO4+ MolecularWeight: 338.80594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]CC3CCCO3

Isomeric SMILES

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]C[C@H]3CCCO3

InChI

InChI=1S/C17H20ClNO4/c1-2-10-6-15(20)23-17-12(10)7-14(18)16(21)13(17)9-19-8-11-4-3-5-22-11/h6-7,11,19,21H,2-5,8-9H2,1H3/p+1/t11-/m1/s1