2-[[cyclohexyl(ethyl)amino]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[cyclohexyl(ethyl)amino]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

CCN(CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C17H21N3O4/c1-2-18(12-7-4-3-5-8-12)11-19-16(21)13-9-6-10-14(20(23)24)15(13)17(19)22/h6,9-10,12H,2-5,7-8,11H2,1H3