2,3-dihydro-1-benzofuran-5-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: 2,3-dihydro-1-benzofuran-5-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: 2,3-dihydrobenzofuran-5-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: 2,3-dihydrobenzofuran-5-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: 2,3-dihydro-1-benzofuran-5-ylmethyl-[(2,3-dimethoxyphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: coumaran-5-ylmethyl-o-veratryl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C23H30NO4+ MolecularWeight: 384.4886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+](CC2CCCO2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+](C[C@H]2CCCO2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C23H29NO4/c1-25-22-7-3-5-19(23(22)26-2)15-24(16-20-6-4-11-27-20)14-17-8-9-21-18(13-17)10-12-28-21/h3,5,7-9,13,20H,4,6,10-12,14-16H2,1-2H3/p+1/t20-/m1/s1