4-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)quinazoline chloride

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)quinazoline chloride Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)quinazoline chloride CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-2-(4-nitrophenyl)quinazoline chloride IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)quinazoline chloride Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(4-nitrophenyl)quinazoline chloride Formula: C19H20ClN5O2 MolecularWeight: 385.8474

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C19H19N5O2.ClH/c1-22-10-12-23(13-11-22)19-16-4-2-3-5-17(16)20-18(21-19)14-6-8-15(9-7-14)24(25)26;/h2-9H,10-13H2,1H3;1H