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

Systemtic Name: 2-[(3-methylquinoxalin-2-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(3-methylquinoxalin-2-yl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(3-methyl-2-quinoxalinyl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(3-methylquinoxalin-2-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(3-methylquinoxalin-2-yl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C18H12N4O4 MolecularWeight: 348.31228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O4/c1-10-16(20-15-5-3-2-4-14(15)19-10)9-21-17(23)12-7-6-11(22(25)26)8-13(12)18(21)24/h2-8H,9H2,1H3