2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(quinolin-6-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(quinolin-6-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-(1-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-(6-quinolylmethyl)acetamide CAS Name: 2-[(2R)-1-(1-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-(6-quinolinylmethyl)acetamide IUPAC Name: 2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(quinolin-6-ylmethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(1-naphthylmethyl)piperazin-1-ium-2-yl]-N-(6-quinolylmethyl)acetamide Formula: C27H27N4O2+ MolecularWeight: 439.52888

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCC2=CC3=C(C=C2)N=CC=C3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCC2=CC3=C(C=C2)N=CC=C3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H26N4O2/c32-26(30-17-19-10-11-24-21(15-19)8-4-12-28-24)16-25-27(33)29-13-14-31(25)18-22-7-3-6-20-5-1-2-9-23(20)22/h1-12,15,25H,13-14,16-18H2,(H,29,33)(H,30,32)/p+1/t25-/m1/s1