4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(1-methylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(1-methylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-[(1,3-dioxoisoindolin-2-yl)methyl]-N-(1-methylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-[(1,3-dioxo-2-isoindolyl)methyl]-N-(1-methyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-[(1,3-dioxoisoindol-2-yl)methyl]-N-(1-methylpiperidin-1-ium-4-yl)benzamide Traditional Name: N-(1-methylpiperidin-1-ium-4-yl)-4-(phthalimidomethyl)benzamide Formula: C22H24N3O3+ MolecularWeight: 378.44426

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H23N3O3/c1-24-12-10-17(11-13-24)23-20(26)16-8-6-15(7-9-16)14-25-21(27)18-4-2-3-5-19(18)22(25)28/h2-9,17H,10-14H2,1H3,(H,23,26)/p+1