N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C19H22N3O4S+ MolecularWeight: 388.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC=CS4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O4S/c23-18(12-22-7-1-3-14(22)17-4-2-10-27-17)21-19(24)20-13-5-6-15-16(11-13)26-9-8-25-15/h2,4-6,10-11,14H,1,3,7-9,12H2,(H2,20,21,23,24)/p+1/t14-/m1/s1