N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide

Systemtic Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide Openeye Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]indane-5-carboxamide CAS Name: N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide IUPAC Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide Traditional Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]indane-5-carboxamide Formula: C22H27N2O+ MolecularWeight: 335.46258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N2O/c25-22(21-11-10-19-4-3-5-20(19)14-21)23-15-17-6-8-18(9-7-17)16-24-12-1-2-13-24/h6-11,14H,1-5,12-13,15-16H2,(H,23,25)/p+1