2-[4-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonylquinazolin-4-olate

Systemtic Name: 2-[4-[(3-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonylquinazolin-4-olate Openeye Name: 2-[4-[(3-fluorophenyl)methyl]-3-oxo-piperazine-1-carbonyl]quinazolin-4-olate CAS Name: 2-[[4-[(3-fluorophenyl)methyl]-3-oxo-1-piperazinyl]-oxomethyl]-4-quinazolinolate IUPAC Name: 2-[4-[(3-fluorophenyl)methyl]-3-oxopiperazine-1-carbonyl]quinazolin-4-olate Traditional Name: 2-[4-(3-fluorobenzyl)-3-keto-piperazine-1-carbonyl]quinazolin-4-olate Formula: C20H16FN4O3- MolecularWeight: 379.364443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)C2=NC3=CC=CC=C3C(=N2)[O-])CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(C(=O)CN1C(=O)C2=NC3=CC=CC=C3C(=N2)[O-])CC4=CC(=CC=C4)F

InChI

InChI=1S/C20H17FN4O3/c21-14-5-3-4-13(10-14)11-24-8-9-25(12-17(24)26)20(28)18-22-16-7-2-1-6-15(16)19(27)23-18/h1-7,10H,8-9,11-12H2,(H,22,23,27)/p-1