N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(3-oxidanylidene-1H-isoindol-2-yl)propanamide

Systemtic Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(3-oxidanylidene-1H-isoindol-2-yl)propanamide Openeye Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(1-oxoisoindolin-2-yl)propanamide CAS Name: N-ethyl-N-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]methyl]-3-(3-oxo-1H-isoindol-2-yl)propanamide IUPAC Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(3-oxo-1H-isoindol-2-yl)propanamide Traditional Name: N-ethyl-3-(1-ketoisoindolin-2-yl)-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]propionamide Formula: C25H40N4O2+2 MolecularWeight: 428.6107

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)CCN3CC4=CC=CC=C4C3=O

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)CCN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H38N4O2/c1-3-27(18-20-8-15-28(16-9-20)22-10-13-26(2)14-11-22)24(30)12-17-29-19-21-6-4-5-7-23(21)25(29)31/h4-7,20,22H,3,8-19H2,1-2H3/p+2