7-chloranyl-N-[[(2R)-oxolan-2-yl]methyl]-2-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]quinazolin-4-amine

Systemtic Name: 7-chloranyl-N-[[(2R)-oxolan-2-yl]methyl]-2-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]quinazolin-4-amine Openeye Name: 7-chloro-2-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-amine CAS Name: 7-chloro-N-[[(2R)-2-oxolanyl]methyl]-2-[[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]methyl]-4-quinazolinamine IUPAC Name: 7-chloro-N-[[(2R)-oxolan-2-yl]methyl]-2-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]quinazolin-4-amine Traditional Name: [7-chloro-2-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]quinazolin-4-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C24H29ClN5O2+ MolecularWeight: 454.97236

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC(=NC3=C2C=CC(=C3)Cl)C[NH+]4CCC(CC4)OC5=CN=CC=C5

Isomeric SMILES

C1C[C@@H](OC1)CNC2=NC(=NC3=C2C=CC(=C3)Cl)C[NH+]4CCC(CC4)OC5=CN=CC=C5

InChI

InChI=1S/C24H28ClN5O2/c25-17-5-6-21-22(13-17)28-23(29-24(21)27-15-19-4-2-12-31-19)16-30-10-7-18(8-11-30)32-20-3-1-9-26-14-20/h1,3,5-6,9,13-14,18-19H,2,4,7-8,10-12,15-16H2,(H,27,28,29)/p+1/t19-/m1/s1