2-[(5-ethanoylthiophen-2-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(5-ethanoylthiophen-2-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(5-acetyl-2-thienyl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(5-acetyl-2-thiophenyl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(5-acetylthiophen-2-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(5-acetyl-2-thienyl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C15H10N2O5S MolecularWeight: 330.3153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(S1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H10N2O5S/c1-8(18)13-5-3-10(23-13)7-16-14(19)11-4-2-9(17(21)22)6-12(11)15(16)20/h2-6H,7H2,1H3