(7R)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: (7R)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one Openeye Name: (7R)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one CAS Name: (7R)-2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: (7R)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one Traditional Name: (7R)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-one Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)C3=CC=CC=C3O)N4CC[NH+](CC4)CCO

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)C[C@@H](C2)C3=CC=CC=C3O)N4CC[NH+](CC4)CCO

InChI

InChI=1S/C21H26N4O3/c1-14-20-17(12-15(13-19(20)28)16-4-2-3-5-18(16)27)23-21(22-14)25-8-6-24(7-9-25)10-11-26/h2-5,15,26-27H,6-13H2,1H3/p+1/t15-/m1/s1