(2R,6S)-N-[1,3-bis(oxidanylidene)isoindol-5-yl]-6-methyl-piperidin-1-ium-2-carboxamide

Systemtic Name: (2R,6S)-N-[1,3-bis(oxidanylidene)isoindol-5-yl]-6-methyl-piperidin-1-ium-2-carboxamide Openeye Name: (2R,6S)-N-(1,3-dioxoisoindolin-5-yl)-6-methyl-piperidin-1-ium-2-carboxamide CAS Name: (2R,6S)-N-(1,3-dioxo-5-isoindolyl)-6-methyl-2-piperidin-1-iumcarboxamide IUPAC Name: (2R,6S)-N-(1,3-dioxoisoindol-5-yl)-6-methylpiperidin-1-ium-2-carboxamide Traditional Name: (2R,6S)-N-(1,3-diketoisoindolin-5-yl)-6-methyl-piperidin-1-ium-2-carboxamide Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH2+]1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH2+]1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C15H17N3O3/c1-8-3-2-4-12(16-8)15(21)17-9-5-6-10-11(7-9)14(20)18-13(10)19/h5-8,12,16H,2-4H2,1H3,(H,17,21)(H,18,19,20)/p+1/t8-,12+/m0/s1