N,N-bis[(2R)-butan-2-yl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N,N-bis[(2R)-butan-2-yl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N,N-bis[(1R)-1-methylpropyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N,N-bis[(2R)-butan-2-yl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N,N-bis[(2R)-butan-2-yl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N,N-bis[(1R)-1-methylpropyl]acetamide Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC[C@@H](C)N([C@H](C)CC)C(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5/c1-5-11(3)20(12(4)6-2)15(22)10-19-17(23)13-8-7-9-14(21(25)26)16(13)18(19)24/h7-9,11-12H,5-6,10H2,1-4H3/t11-,12-/m1/s1