(2-phenylquinolin-4-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-phenylquinolin-4-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (2-phenyl-4-quinolyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (2-phenyl-4-quinolinyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2-phenylquinolin-4-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (2-phenyl-4-quinolyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C25H23N4O+ MolecularWeight: 395.47632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O/c30-25(29-16-14-28(15-17-29)24-12-6-7-13-26-24)21-18-23(19-8-2-1-3-9-19)27-22-11-5-4-10-20(21)22/h1-13,18H,14-17H2/p+1