4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethyl-azanium chloride

Systemtic Name: 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethyl-azanium chloride Openeye Name: 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethyl-ammonium chloride CAS Name: 4-[(3-chloroanilino)-oxomethoxy]but-2-ynyl-trimethylammonium chloride IUPAC Name: 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethylazanium chloride Traditional Name: 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethyl-ammonium chloride Formula: C14H18Cl2N2O2 MolecularWeight: 317.21092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC#CCOC(=O)NC1=CC(=CC=C1)Cl.[Cl-]

Isomeric SMILES

C[N+](C)(C)CC#CCOC(=O)NC1=CC(=CC=C1)Cl.[Cl-]

InChI

InChI=1S/C14H17ClN2O2.ClH/c1-17(2,3)9-4-5-10-19-14(18)16-13-8-6-7-12(15)11-13;/h6-8,11H,9-10H2,1-3H3;1H