4-(4-methylpiperazin-4-ium-1-yl)-2-(3-nitrophenyl)quinazoline

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(3-nitrophenyl)quinazoline Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(3-nitrophenyl)quinazoline CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-2-(3-nitrophenyl)quinazoline IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(3-nitrophenyl)quinazoline Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(3-nitrophenyl)quinazoline Formula: C19H20N5O2+ MolecularWeight: 350.3944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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