1-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-phenyl-2-quinolin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 1-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-phenylquinolin-1-ium-2-yl)piperazino]ethanone Formula: C21H22N3O+ MolecularWeight: 332.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=[NH+]C3=CC=CC=C3C(=C2)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=[NH+]C3=CC=CC=C3C(=C2)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O/c1-16(25)23-11-13-24(14-12-23)21-15-19(17-7-3-2-4-8-17)18-9-5-6-10-20(18)22-21/h2-10,15H,11-14H2,1H3/p+1