7-chloranyl-4-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]quinoline

Systemtic Name: 7-chloranyl-4-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]quinoline Openeye Name: 7-chloro-2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-methyl-quinoline CAS Name: 7-chloro-4-methyl-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]quinoline IUPAC Name: 7-chloro-4-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]quinoline Traditional Name: 7-chloro-2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4-methyl-quinoline Formula: C23H25ClN3+ MolecularWeight: 378.9177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC(=C2)Cl)N3CC[NH+](CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=C1C=CC(=C2)Cl)N3CC[NH+](CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H24ClN3/c1-18-16-23(25-22-17-20(24)9-10-21(18)22)27-14-12-26(13-15-27)11-5-8-19-6-3-2-4-7-19/h2-10,16-17H,11-15H2,1H3/p+1/b8-5+