2-(3-methyl-4-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(3-methyl-4-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(3-methyl-4-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(3-methyl-4-nitrophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(3-methyl-4-nitrophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(3-methyl-4-nitro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C3CCCCC3C2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C3CCCCC3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4/c1-9-8-10(6-7-13(9)17(20)21)16-14(18)11-4-2-3-5-12(11)15(16)19/h6-8,11-12H,2-5H2,1H3