(2,3-dimethoxyphenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Traditional Name: o-veratryl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium Formula: C17H22NO3+ MolecularWeight: 288.36148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH2+]C2CCCC3=C2C=CO3

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH2+][C@H]2CCCC3=C2C=CO3

InChI

InChI=1S/C17H21NO3/c1-19-16-8-3-5-12(17(16)20-2)11-18-14-6-4-7-15-13(14)9-10-21-15/h3,5,8-10,14,18H,4,6-7,11H2,1-2H3/p+1/t14-/m0/s1