(3R)-4-(naphthalen-1-ylmethyl)-3-[2-oxidanylidene-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-(naphthalen-1-ylmethyl)-3-[2-oxidanylidene-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-(1-naphthylmethyl)-3-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-(1-naphthalenylmethyl)-3-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-(naphthalen-1-ylmethyl)-3-[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-keto-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-4-(1-naphthylmethyl)piperazin-4-ium-2-one Formula: C28H30N3O2+ MolecularWeight: 440.5567

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)CC3C(=O)NCC[NH+]3CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)C[C@@H]3C(=O)NCC[NH+]3CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H29N3O2/c32-27(30-16-13-22(14-17-30)21-7-2-1-3-8-21)19-26-28(33)29-15-18-31(26)20-24-11-6-10-23-9-4-5-12-25(23)24/h1-13,26H,14-20H2,(H,29,33)/p+1/t26-/m1/s1