[(2R)-4-(furan-2-yl)butan-2-yl]-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: [(2R)-4-(furan-2-yl)butan-2-yl]-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium Openeye Name: [(1R)-3-(2-furyl)-1-methyl-propyl]-[(4-hydroxy-3-methoxy-phenyl)methyl]ammonium CAS Name: [(2R)-4-(2-furanyl)butan-2-yl]-[(4-hydroxy-3-methoxyphenyl)methyl]ammonium IUPAC Name: [(2R)-4-(furan-2-yl)butan-2-yl]-[(4-hydroxy-3-methoxyphenyl)methyl]azanium Traditional Name: [(1R)-3-(2-furyl)-1-methyl-propyl]-vanillyl-ammonium Formula: C16H22NO3+ MolecularWeight: 276.35078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CO1)[NH2+]CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

C[C@H](CCC1=CC=CO1)[NH2+]CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C16H21NO3/c1-12(5-7-14-4-3-9-20-14)17-11-13-6-8-15(18)16(10-13)19-2/h3-4,6,8-10,12,17-18H,5,7,11H2,1-2H3/p+1/t12-/m1/s1