N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-2-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-1,3-diketo-2-methyl-isoindoline-5-carboxamide Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3/c1-4-26-9-11-27(12-10-26)17-6-8-20(15(2)13-17)24-21(28)16-5-7-18-19(14-16)23(30)25(3)22(18)29/h5-8,13-14H,4,9-12H2,1-3H3,(H,24,28)/p+1