3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyrido[2,3-d]pyrimidin-4-one Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN3C=NC4=C(C3=O)C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN3C=NC4=C(C3=O)C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5/c21-16-13-2-1-3-17-15(13)18-8-19(16)6-10-4-12(20(22)23)5-11-7-24-9-25-14(10)11/h1-5,8H,6-7,9H2