N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-1,3-diketo-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]isoindoline-5-carboxamide Formula: C23H25N4O3+ MolecularWeight: 405.4696

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC=C

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC=C

InChI

InChI=1S/C23H24N4O3/c1-3-10-27-22(29)17-9-8-16(15-18(17)23(27)30)21(28)24-19-6-4-5-7-20(19)26-13-11-25(2)12-14-26/h3-9,15H,1,10-14H2,2H3,(H,24,28)/p+1