2-(morpholin-4-ylmethyl)-N-(2,4,4-trimethylpentan-2-yl)quinazolin-3-ium-4-amine

Systemtic Name: 2-(morpholin-4-ylmethyl)-N-(2,4,4-trimethylpentan-2-yl)quinazolin-3-ium-4-amine Openeye Name: 2-(morpholinomethyl)-N-(1,1,3,3-tetramethylbutyl)quinazolin-3-ium-4-amine CAS Name: 2-(4-morpholinylmethyl)-N-(2,4,4-trimethylpentan-2-yl)-4-quinazolin-3-iumamine IUPAC Name: 2-(morpholin-4-ylmethyl)-N-(2,4,4-trimethylpentan-2-yl)quinazolin-3-ium-4-amine Traditional Name: [2-(morpholinomethyl)quinazolin-3-ium-4-yl]-(1,1,3,3-tetramethylbutyl)amine Formula: C21H33N4O+ MolecularWeight: 357.51292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC1=[NH+]C(=NC2=CC=CC=C21)CN3CCOCC3

Isomeric SMILES

CC(C)(C)CC(C)(C)NC1=[NH+]C(=NC2=CC=CC=C21)CN3CCOCC3

InChI

InChI=1S/C21H32N4O/c1-20(2,3)15-21(4,5)24-19-16-8-6-7-9-17(16)22-18(23-19)14-25-10-12-26-13-11-25/h6-9H,10-15H2,1-5H3,(H,22,23,24)/p+1