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

Systemtic Name: (3S)-N-[1,3-bis(oxidanylidene)isoindol-5-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(1,3-dioxoisoindolin-5-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(1,3-dioxo-5-isoindolyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(1,3-dioxoisoindol-5-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(1,3-diketoisoindolin-5-yl)piperidin-1-ium-3-carboxamide Formula: C14H16N3O3+ MolecularWeight: 274.29514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C14H15N3O3/c18-12(8-2-1-5-15-7-8)16-9-3-4-10-11(6-9)14(20)17-13(10)19/h3-4,6,8,15H,1-2,5,7H2,(H,16,18)(H,17,19,20)/p+1/t8-/m0/s1