2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[(4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitro-isoindoline-1,3-quinone Formula: C18H12N4O5 MolecularWeight: 364.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O5/c1-10-4-2-7-14-19-11(8-15(23)21(10)14)9-20-17(24)12-5-3-6-13(22(26)27)16(12)18(20)25/h2-8H,9H2,1H3