2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-ium-1-yl]-1-morpholino-ethanone Formula: C19H27N6O2+ MolecularWeight: 371.45668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C19H26N6O2/c20-19-15-3-1-2-4-16(15)21-17(22-19)13-23-5-7-24(8-6-23)14-18(26)25-9-11-27-12-10-25/h1-4H,5-14H2,(H2,20,21,22)/p+1