3-[2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanoyl]chromen-2-one

Systemtic Name: 3-[2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanoyl]chromen-2-one Openeye Name: 3-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]chromen-2-one CAS Name: 3-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]chromen-2-one Traditional Name: 3-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]coumarin Formula: C13H7BrN4O5 MolecularWeight: 379.12248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CN3C(=NC(=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CN3C(=NC(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C13H7BrN4O5/c14-12-15-13(18(21)22)16-17(12)6-9(19)8-5-7-3-1-2-4-10(7)23-11(8)20/h1-5H,6H2