N-(4-methoxyphenyl)-2-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(4-methoxyphenyl)-2-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(4-methoxyphenyl)-2-[[2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-methoxyphenyl)-2-[[1-oxo-2-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-(4-methoxyphenyl)-2-[[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(4-methoxyphenyl)-2-[[2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C24H26N3O3S+ MolecularWeight: 436.54654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCCC3C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC[C@H]3C4=CC=CS4

InChI

InChI=1S/C24H25N3O3S/c1-30-18-12-10-17(11-13-18)25-24(29)19-6-2-3-7-20(19)26-23(28)16-27-14-4-8-21(27)22-9-5-15-31-22/h2-3,5-7,9-13,15,21H,4,8,14,16H2,1H3,(H,25,29)(H,26,28)/p+1/t21-/m0/s1