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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O3/c1-8-2-3-9(7-16-8)13(19)17-10-4-5-11-12(6-10)15(21)18-14(11)20/h4-6,8-9,16H,2-3,7H2,1H3,(H,17,19)(H,18,20,21)/p+1/t8-,9-/m0/s1