3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[2-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]propanamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-3-phthalimido-propionamide Formula: C23H25N4O4+ MolecularWeight: 421.469

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N4O4/c1-25-12-14-26(15-13-25)21(29)18-8-4-5-9-19(18)24-20(28)10-11-27-22(30)16-6-2-3-7-17(16)23(27)31/h2-9H,10-15H2,1H3,(H,24,28)/p+1