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

Systemtic Name: (7S)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one Openeye Name: (7S)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one CAS Name: (7S)-2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: (7S)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one Traditional Name: (7S)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=NC=C3C(=N2)CC(CC3=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=NC=C3C(=N2)C[C@@H](CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4O2/c25-11-10-23-6-8-24(9-7-23)20-21-14-17-18(22-20)12-16(13-19(17)26)15-4-2-1-3-5-15/h1-5,14,16,25H,6-13H2/p+1/t16-/m0/s1