N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(6-methyl-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(6-methyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(6-methylbenzofuran-3-yl)acetamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-(6-methyl-3-benzofuranyl)acetamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-(6-methyl-1-benzofuran-3-yl)acetamide Traditional Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(6-methylbenzofuran-3-yl)acetamide Formula: C24H29N2O3+ MolecularWeight: 393.49866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NCC(C3=CC=C(C=C3)OC)[NH+]4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NC[C@H](C3=CC=C(C=C3)OC)[NH+]4CCCC4

InChI

InChI=1S/C24H28N2O3/c1-17-5-10-21-19(16-29-23(21)13-17)14-24(27)25-15-22(26-11-3-4-12-26)18-6-8-20(28-2)9-7-18/h5-10,13,16,22H,3-4,11-12,14-15H2,1-2H3,(H,25,27)/p+1/t22-/m1/s1