methyl-(phenylmethyl)-[2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]ethyl]azanium

Systemtic Name: methyl-(phenylmethyl)-[2-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]ethyl]azanium Openeye Name: benzyl-methyl-[2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]ethyl]ammonium CAS Name: methyl-[2-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]ethyl]azanium Traditional Name: benzyl-methyl-[2-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]ethyl]ammonium Formula: C25H25N4O+ MolecularWeight: 397.4922

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)CC4=CC=CC=C4

Isomeric SMILES

C[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O/c1-29(18-19-7-3-2-4-8-19)16-15-27-25(30)22-17-24(20-11-13-26-14-12-20)28-23-10-6-5-9-21(22)23/h2-14,17H,15-16,18H2,1H3,(H,27,30)/p+1