[(2S)-3-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-6-yl)oxy-2-oxidanyl-propyl]-(2-methylpropyl)azanium

Systemtic Name: [(2S)-3-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-6-yl)oxy-2-oxidanyl-propyl]-(2-methylpropyl)azanium Openeye Name: [(2S)-3-(7,8-dimethoxy-4-methyl-2-oxo-chromen-6-yl)oxy-2-hydroxy-propyl]-isobutyl-ammonium CAS Name: [(2S)-3-[(7,8-dimethoxy-4-methyl-2-oxo-1-benzopyran-6-yl)oxy]-2-hydroxypropyl]-(2-methylpropyl)ammonium IUPAC Name: [(2S)-3-(7,8-dimethoxy-4-methyl-2-oxochromen-6-yl)oxy-2-hydroxypropyl]-(2-methylpropyl)azanium Traditional Name: [(2S)-2-hydroxy-3-(2-keto-7,8-dimethoxy-4-methyl-chromen-6-yl)oxy-propyl]-isobutyl-ammonium Formula: C19H28NO6+ MolecularWeight: 366.42872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(C[NH2+]CC(C)C)O)OC)OC

Isomeric SMILES

CC1=CC(=O)OC2=C(C(=C(C=C12)OC[C@H](C[NH2+]CC(C)C)O)OC)OC

InChI

InChI=1S/C19H27NO6/c1-11(2)8-20-9-13(21)10-25-15-7-14-12(3)6-16(22)26-17(14)19(24-5)18(15)23-4/h6-7,11,13,20-21H,8-10H2,1-5H3/p+1/t13-/m0/s1