2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]azanium

Systemtic Name: 2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]azanium Openeye Name: 2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]ammonium CAS Name: 2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]ammonium IUPAC Name: 2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]azanium Traditional Name: 2-acetamidoethyl-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]ammonium Formula: C16H25N2O3+ MolecularWeight: 293.3813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)C[NH2+]CCNC(=O)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)C[NH2+]CCNC(=O)C

InChI

InChI=1S/C16H24N2O3/c1-4-20-15-8-13-7-11(2)21-16(13)9-14(15)10-17-5-6-18-12(3)19/h8-9,11,17H,4-7,10H2,1-3H3,(H,18,19)/p+1/t11-/m0/s1