N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[(2S)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C[NH+]2CCCC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C[NH+]2CCCC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O2/c1-28-18-10-8-17(9-11-18)20(14-25-23(27)16-26-12-4-5-13-26)21-15-24-22-7-3-2-6-19(21)22/h2-3,6-11,15,20,24H,4-5,12-14,16H2,1H3,(H,25,27)/p+1/t20-/m0/s1