3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-methoxy-2-methyl-quinazolin-4-one

Systemtic Name: 3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-methoxy-2-methyl-quinazolin-4-one Openeye Name: 3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-methoxy-2-methyl-quinazolin-4-one CAS Name: 3-[[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]methyl]-6-methoxy-2-methyl-4-quinazolinone IUPAC Name: 3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-methoxy-2-methylquinazolin-4-one Traditional Name: 3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-methoxy-2-methyl-quinazolin-4-one Formula: C17H25N4O3+ MolecularWeight: 333.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1C[NH+]3CCN(CC3)CCO

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1C[NH+]3CCN(CC3)CCO

InChI

InChI=1S/C17H24N4O3/c1-13-18-16-4-3-14(24-2)11-15(16)17(23)21(13)12-20-7-5-19(6-8-20)9-10-22/h3-4,11,22H,5-10,12H2,1-2H3/p+1