(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-bis(2-methylpropyl)azanium

Systemtic Name: (6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-bis(2-methylpropyl)azanium Openeye Name: (6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl-diisobutyl-ammonium CAS Name: (6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-bis(2-methylpropyl)ammonium IUPAC Name: (6-chloro-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-bis(2-methylpropyl)azanium Traditional Name: (6-chloro-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl-diisobutyl-ammonium Formula: C19H27ClNO3+ MolecularWeight: 352.87558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH+](CC(C)C)CC(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH+](CC(C)C)CC(C)C

InChI

InChI=1S/C19H26ClNO3/c1-11(2)8-21(9-12(3)4)10-15-18(23)16(20)7-14-13(5)6-17(22)24-19(14)15/h6-7,11-12,23H,8-10H2,1-5H3/p+1