dimethyl-[[3-[(R)-(4-methylphenyl)-oxidanyl-methyl]-5-oxidanyl-1-benzofuran-4-yl]methyl]azanium

Systemtic Name: dimethyl-[[3-[(R)-(4-methylphenyl)-oxidanyl-methyl]-5-oxidanyl-1-benzofuran-4-yl]methyl]azanium Openeye Name: [5-hydroxy-3-[(R)-hydroxy(p-tolyl)methyl]benzofuran-4-yl]methyl-dimethyl-ammonium CAS Name: [5-hydroxy-3-[(R)-hydroxy-(4-methylphenyl)methyl]-4-benzofuranyl]methyl-dimethylammonium IUPAC Name: [5-hydroxy-3-[(R)-hydroxy-(4-methylphenyl)methyl]-1-benzofuran-4-yl]methyl-dimethylazanium Traditional Name: [5-hydroxy-3-[(R)-hydroxy(p-tolyl)methyl]benzofuran-4-yl]methyl-dimethyl-ammonium Formula: C19H22NO3+ MolecularWeight: 312.38288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=COC3=C2C(=C(C=C3)O)C[NH+](C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=COC3=C2C(=C(C=C3)O)C[NH+](C)C)O

InChI

InChI=1S/C19H21NO3/c1-12-4-6-13(7-5-12)19(22)15-11-23-17-9-8-16(21)14(18(15)17)10-20(2)3/h4-9,11,19,21-22H,10H2,1-3H3/p+1/t19-/m1/s1