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

Systemtic Name: dimethyl-[3-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-3-oxidanylidene-propyl]azanium Openeye Name: dimethyl-[3-[(2S)-2-methyl-2,3-dihydrobenzofuran-5-yl]-3-oxo-propyl]ammonium CAS Name: dimethyl-[3-[(2S)-2-methyl-2,3-dihydrobenzofuran-5-yl]-3-oxopropyl]ammonium IUPAC Name: dimethyl-[3-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[(2S)-2-methylcoumaran-5-yl]propyl]-dimethyl-ammonium Formula: C14H20NO2+ MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C(=O)CC[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO2/c1-10-8-12-9-11(4-5-14(12)17-10)13(16)6-7-15(2)3/h4-5,9-10H,6-8H2,1-3H3/p+1/t10-/m0/s1