3,4-dihydro-2H-quinolin-1-yl-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone

Systemtic Name: 3,4-dihydro-2H-quinolin-1-yl-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Openeye Name: 3,4-dihydro-2H-quinolin-1-yl-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone CAS Name: 3,4-dihydro-2H-quinolin-1-yl-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methanone IUPAC Name: 3,4-dihydro-2H-quinolin-1-yl-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Traditional Name: 3,4-dihydro-2H-quinolin-1-yl-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Formula: C21H25N2O+ MolecularWeight: 321.436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)C(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)C(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C21H24N2O/c24-21(23-15-5-7-18-6-1-2-8-20(18)23)19-11-9-17(10-12-19)16-22-13-3-4-14-22/h1-2,6,8-12H,3-5,7,13-16H2/p+1