(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-cyclohexyl-ethyl-azanium

Systemtic Name: (6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-cyclohexyl-ethyl-azanium Openeye Name: (6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl-cyclohexyl-ethyl-ammonium CAS Name: (6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-cyclohexyl-ethylammonium IUPAC Name: (6-chloro-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-cyclohexyl-ethylazanium Traditional Name: (6-chloro-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl-cyclohexyl-ethyl-ammonium Formula: C19H25ClNO3+ MolecularWeight: 350.8597

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C)C3CCCCC3

Isomeric SMILES

CC[NH+](CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C)C3CCCCC3

InChI

InChI=1S/C19H24ClNO3/c1-3-21(13-7-5-4-6-8-13)11-15-18(23)16(20)10-14-12(2)9-17(22)24-19(14)15/h9-10,13,23H,3-8,11H2,1-2H3/p+1