(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2R)-3-methylbutan-2-yl]azanium

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2R)-3-methylbutan-2-yl]azanium Openeye Name: [(1R)-1,2-dimethylpropyl]-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(2R)-3-methylbutan-2-yl]ammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-[(2R)-3-methylbutan-2-yl]azanium Traditional Name: [(1R)-1,2-dimethylpropyl]-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C17H24NO3+ MolecularWeight: 290.37736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]C(C)C(C)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+][C@H](C)C(C)C)O

InChI

InChI=1S/C17H23NO3/c1-5-12-6-14-13(9-18-11(4)10(2)3)7-17(20)21-16(14)8-15(12)19/h6-8,10-11,18-19H,5,9H2,1-4H3/p+1/t11-/m1/s1