4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]butanamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phthalimido-butyramide Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H28N4O3/c1-2-26-14-16-27(17-15-26)21-11-6-5-10-20(21)25-22(29)12-7-13-28-23(30)18-8-3-4-9-19(18)24(28)31/h3-6,8-11H,2,7,12-17H2,1H3,(H,25,29)/p+1