(2R)-2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)propanamide

Systemtic Name: (2R)-2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)propanamide Openeye Name: (2R)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-furylmethyl)propanamide CAS Name: (2R)-2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-N-(2-furanylmethyl)propanamide IUPAC Name: (2R)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(furan-2-ylmethyl)propanamide Traditional Name: (2R)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-furfuryl)propionamide Formula: C25H30N3O2+ MolecularWeight: 404.5246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CO1)[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-20(25(29)26-19-23-13-8-18-30-23)27-14-16-28(17-15-27)24(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-13,18,20,24H,14-17,19H2,1H3,(H,26,29)/p+1/t20-/m1/s1