2-[1-oxidanyl-2-oxidanylidene-3-(3-oxidanylpropyl)-1-phenethyl-pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-[1-oxidanyl-2-oxidanylidene-3-(3-oxidanylpropyl)-1-phenethyl-pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: 2-[1-hydroxy-3-(3-hydroxypropyl)-2-oxo-1-phenethyl-pyrrolidin-1-ium-3-yl]acetamide CAS Name: 2-[1-hydroxy-3-(3-hydroxypropyl)-2-oxo-1-phenethyl-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[1-hydroxy-3-(3-hydroxypropyl)-2-oxo-1-phenethylpyrrolidin-1-ium-3-yl]acetamide Traditional Name: 2-[1-hydroxy-3-(3-hydroxypropyl)-2-keto-1-phenethyl-pyrrolidin-1-ium-3-yl]acetamide Formula: C17H25N2O4+ MolecularWeight: 321.3914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](C(=O)C1(CCCO)CC(=O)N)(CCC2=CC=CC=C2)O

Isomeric SMILES

C1C[N+](C(=O)C1(CCCO)CC(=O)N)(CCC2=CC=CC=C2)O

InChI

InChI=1S/C17H24N2O4/c18-15(21)13-17(8-4-12-20)9-11-19(23,16(17)22)10-7-14-5-2-1-3-6-14/h1-3,5-6,20,23H,4,7-13H2,(H-,18,21)/p+1