2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(6,7-dimethylbenzofuran-3-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(6,7-dimethyl-3-benzofuranyl)-N-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(6,7-dimethylbenzofuran-3-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide Formula: C25H31N2O3+ MolecularWeight: 407.52524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NCC(C3=CC=C(C=C3)OC)[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NC[C@H](C3=CC=C(C=C3)OC)[NH+]4CCCC4)C

InChI

InChI=1S/C25H30N2O3/c1-17-6-11-22-20(16-30-25(22)18(17)2)14-24(28)26-15-23(27-12-4-5-13-27)19-7-9-21(29-3)10-8-19/h6-11,16,23H,4-5,12-15H2,1-3H3,(H,26,28)/p+1/t23-/m1/s1