7-nitro-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide

Systemtic Name: 7-nitro-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Openeye Name: 7-nitro-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide CAS Name: 7-nitro-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide IUPAC Name: 7-nitro-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Traditional Name: N-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]-7-nitro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide Formula: C16H12N6O5 MolecularWeight: 368.30368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=NC=NC4=C3NC=C4[N+](=O)[O-]

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=NC=NC4=C3NC=C4[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O5/c23-12-6-27-11-2-1-8(3-9(11)21-12)4-18-16(24)15-14-13(19-7-20-15)10(5-17-14)22(25)26/h1-3,5,7,17H,4,6H2,(H,18,24)(H,21,23)