[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methyl-propan-2-yl-azanium

Systemtic Name: [(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methyl-propan-2-yl-azanium Openeye Name: isopropyl-[[(2S)-2-methyl-2,3-dihydrobenzofuran-5-yl]methyl]ammonium CAS Name: [(2S)-2-methyl-2,3-dihydrobenzofuran-5-yl]methyl-propan-2-ylammonium IUPAC Name: [(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methyl-propan-2-ylazanium Traditional Name: isopropyl-[[(2S)-2-methylcoumaran-5-yl]methyl]ammonium Formula: C13H20NO+ MolecularWeight: 206.304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C[NH2+]C(C)C

Isomeric SMILES

C[C@H]1CC2=C(O1)C=CC(=C2)C[NH2+]C(C)C

InChI

InChI=1S/C13H19NO/c1-9(2)14-8-11-4-5-13-12(7-11)6-10(3)15-13/h4-5,7,9-10,14H,6,8H2,1-3H3/p+1/t10-/m0/s1