(2R)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-indan-5-yl-2-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-indan-5-yl-2-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C22H28N3O+ MolecularWeight: 350.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(CCC2)C=C1)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(CCC2)C=C1)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O/c1-17(22(26)23-20-11-10-18-6-5-7-19(18)16-20)24-12-14-25(15-13-24)21-8-3-2-4-9-21/h2-4,8-11,16-17H,5-7,12-15H2,1H3,(H,23,26)/p+1/t17-/m1/s1