3-[3-(2-thiophen-2-ylethylcarbamoyl)phenoxy]propylazanium

Systemtic Name: 3-[3-(2-thiophen-2-ylethylcarbamoyl)phenoxy]propylazanium Openeye Name: 3-[3-[2-(2-thienyl)ethylcarbamoyl]phenoxy]propylammonium CAS Name: 3-[3-[oxo-(2-thiophen-2-ylethylamino)methyl]phenoxy]propylammonium IUPAC Name: 3-[3-(2-thiophen-2-ylethylcarbamoyl)phenoxy]propylazanium Traditional Name: 3-[3-[2-(2-thienyl)ethylcarbamoyl]phenoxy]propylammonium Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCC[NH3+])C(=O)NCCC2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)OCCC[NH3+])C(=O)NCCC2=CC=CS2

InChI

InChI=1S/C16H20N2O2S/c17-8-3-10-20-14-5-1-4-13(12-14)16(19)18-9-7-15-6-2-11-21-15/h1-2,4-6,11-12H,3,7-10,17H2,(H,18,19)/p+1