[(S)-[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-propan-2-yloxyphenyl)methyl]azanium

Systemtic Name: [(S)-[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-propan-2-yloxyphenyl)methyl]azanium Openeye Name: [(S)-[(2R)-2,3-dihydrobenzofuran-2-yl]-(4-isopropoxyphenyl)methyl]ammonium CAS Name: [(S)-[(2R)-2,3-dihydrobenzofuran-2-yl]-(4-propan-2-yloxyphenyl)methyl]ammonium IUPAC Name: [(S)-[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-propan-2-yloxyphenyl)methyl]azanium Traditional Name: [(S)-[(2R)-coumaran-2-yl]-(4-isopropoxyphenyl)methyl]ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C2CC3=CC=CC=C3O2)[NH3+]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H]([C@H]2CC3=CC=CC=C3O2)[NH3+]

InChI

InChI=1S/C18H21NO2/c1-12(2)20-15-9-7-13(8-10-15)18(19)17-11-14-5-3-4-6-16(14)21-17/h3-10,12,17-18H,11,19H2,1-2H3/p+1/t17-,18+/m1/s1