7-chloranyl-2-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C19H20ClN4O2+ MolecularWeight: 371.8407

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4=CC=CC=C4O

InChI

InChI=1S/C19H19ClN4O2/c20-13-5-6-14-15(11-13)21-18(22-19(14)26)12-23-7-9-24(10-8-23)16-3-1-2-4-17(16)25/h1-6,11,25H,7-10,12H2,(H,21,22,26)/p+1