[(3S)-1-(2-methoxyquinolin-4-yl)carbonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(3S)-1-(2-methoxyquinolin-4-yl)carbonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(3S)-1-(2-methoxyquinoline-4-carbonyl)-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(3S)-1-[(2-methoxy-4-quinolinyl)-oxomethyl]-3-piperidinyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3S)-1-(2-methoxyquinoline-4-carbonyl)piperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(3S)-1-(2-methoxyquinoline-4-carbonyl)-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)C2CCCN(C2)C(=O)C3=CC(=NC4=CC=CC=C43)OC

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)[C@H]2CCCN(C2)C(=O)C3=CC(=NC4=CC=CC=C43)OC

InChI

InChI=1S/C24H28N4O2/c1-27(15-12-18-8-5-6-13-25-18)19-9-7-14-28(17-19)24(29)21-16-23(30-2)26-22-11-4-3-10-20(21)22/h3-6,8,10-11,13,16,19H,7,9,12,14-15,17H2,1-2H3/p+1/t19-/m0/s1