N-cyclopropyl-4-methyl-3-[4-oxidanylidene-6-(4-oxidanylidenepiperazin-4-ium-1-yl)quinazolin-3-yl]benzenecarboximidate

Systemtic Name: N-cyclopropyl-4-methyl-3-[4-oxidanylidene-6-(4-oxidanylidenepiperazin-4-ium-1-yl)quinazolin-3-yl]benzenecarboximidate Openeye Name: N-cyclopropyl-4-methyl-3-[4-oxo-6-(4-oxopiperazin-4-ium-1-yl)quinazolin-3-yl]benzenecarboximidate CAS Name: N-cyclopropyl-4-methyl-3-[4-oxo-6-(4-oxo-1-piperazin-4-iumyl)-3-quinazolinyl]benzenecarboximidate IUPAC Name: N-cyclopropyl-4-methyl-3-[4-oxo-6-(4-oxopiperazin-4-ium-1-yl)quinazolin-3-yl]benzenecarboximidate Traditional Name: N-cyclopropyl-3-[4-keto-6-(4-ketopiperazin-4-ium-1-yl)quinazolin-3-yl]-4-methyl-benzenecarboximidate Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NC2CC2)[O-])N3C=NC4=C(C3=O)C=C(C=C4)N5CC[N+](=O)CC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=NC2CC2)[O-])N3C=NC4=C(C3=O)C=C(C=C4)N5CC[N+](=O)CC5

InChI

InChI=1S/C23H23N5O3/c1-15-2-3-16(22(29)25-17-4-5-17)12-21(15)28-14-24-20-7-6-18(13-19(20)23(28)30)26-8-10-27(31)11-9-26/h2-3,6-7,12-14,17H,4-5,8-11H2,1H3