2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)N3CC[NH+](CC3)CCO

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)N3CC[NH+](CC3)CCO

InChI

InChI=1S/C17H26N4O2/c1-12-15-13(10-17(2,3)11-14(15)23)19-16(18-12)21-6-4-20(5-7-21)8-9-22/h22H,4-11H2,1-3H3/p+1