3-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-1H-quinazoline-2,4-dione CAS Name: 3-[2-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-1H-quinazoline-2,4-quinone Formula: C20H21N4O3+ MolecularWeight: 365.40574

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C20H20N4O3/c1-22-10-12-23(13-11-22)18(25)15-7-3-5-9-17(15)24-19(26)14-6-2-4-8-16(14)21-20(24)27/h2-9H,10-13H2,1H3,(H,21,27)/p+1