N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C21H29N3OS+2 MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C[NH+]3CCCC3C4=CC=CS4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C[NH+]3CCC[C@@H]3C4=CC=CS4

InChI

InChI=1S/C21H27N3OS/c25-21(16-24-13-3-5-19(24)20-6-4-14-26-20)22-18-9-7-17(8-10-18)15-23-11-1-2-12-23/h4,6-10,14,19H,1-3,5,11-13,15-16H2,(H,22,25)/p+2/t19-/m1/s1