carboxycarbonyl-methyl-(2-phenylethanoyl)-(1-phenyl-2-pyrrolidin-1-yl-ethyl)azanium hydrochloride

Systemtic Name: carboxycarbonyl-methyl-(2-phenylethanoyl)-(1-phenyl-2-pyrrolidin-1-yl-ethyl)azanium hydrochloride Openeye Name: methyl-oxalo-(2-phenylacetyl)-(1-phenyl-2-pyrrolidin-1-yl-ethyl)ammonium hydrochloride CAS Name: methyl-oxalo-(1-oxo-2-phenylethyl)-[1-phenyl-2-(1-pyrrolidinyl)ethyl]ammonium hydrochloride IUPAC Name: methyl-oxalo-(2-phenylacetyl)-(1-phenyl-2-pyrrolidin-1-ylethyl)azanium hydrochloride Traditional Name: methyl-oxalo-(2-phenylacetyl)-(1-phenyl-2-pyrrolidino-ethyl)ammonium hydrochloride Formula: C23H28ClN2O4+ MolecularWeight: 431.93242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C(CN1CCCC1)C2=CC=CC=C2)(C(=O)CC3=CC=CC=C3)C(=O)C(=O)O.Cl

Isomeric SMILES

C[N+](C(CN1CCCC1)C2=CC=CC=C2)(C(=O)CC3=CC=CC=C3)C(=O)C(=O)O.Cl

InChI

InChI=1S/C23H26N2O4.ClH/c1-25(22(27)23(28)29,21(26)16-18-10-4-2-5-11-18)20(17-24-14-8-9-15-24)19-12-6-3-7-13-19;/h2-7,10-13,20H,8-9,14-17H2,1H3;1H/p+1