(E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]but-2-en-1-one Formula: C19H23N2O+ MolecularWeight: 295.39872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C/C=C/C(=O)N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H22N2O/c1-2-6-19(22)21-13-11-20(12-14-21)15-17-9-5-8-16-7-3-4-10-18(16)17/h2-10H,11-15H2,1H3/p+1/b6-2+