3-methyl-3-(7-nitro-3-oxidanylidene-1H-isoindol-2-yl)piperidine-2,6-dione

Systemtic Name: 3-methyl-3-(7-nitro-3-oxidanylidene-1H-isoindol-2-yl)piperidine-2,6-dione Openeye Name: 3-methyl-3-(4-nitro-1-oxo-isoindolin-2-yl)piperidine-2,6-dione CAS Name: 3-methyl-3-(7-nitro-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione IUPAC Name: 3-methyl-3-(7-nitro-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione Traditional Name: 3-(1-keto-4-nitro-isoindolin-2-yl)-3-methyl-piperidine-2,6-quinone Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)NC1=O)N2CC3=C(C2=O)C=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1(CCC(=O)NC1=O)N2CC3=C(C2=O)C=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5/c1-14(6-5-11(18)15-13(14)20)16-7-9-8(12(16)19)3-2-4-10(9)17(21)22/h2-4H,5-7H2,1H3,(H,15,18,20)