2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-1,3-dioxo-2-(p-tolyl)isoindoline-5-carboxamide CAS Name: 2-(4-methylphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(2-morpholin-4-ium-4-ylethyl)-2-(p-tolyl)isoindoline-5-carboxamide Formula: C22H24N3O4+ MolecularWeight: 394.44366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C22H23N3O4/c1-15-2-5-17(6-3-15)25-21(27)18-7-4-16(14-19(18)22(25)28)20(26)23-8-9-24-10-12-29-13-11-24/h2-7,14H,8-13H2,1H3,(H,23,26)/p+1