6-bromanyl-8-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-oxidanylidene-chromene-3-carbaldehyde

Systemtic Name: 6-bromanyl-8-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 6-bromo-8-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-oxo-chromene-3-carbaldehyde CAS Name: 6-bromo-8-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 6-bromo-8-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-oxochromene-3-carbaldehyde Traditional Name: 6-bromo-8-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-keto-chromene-3-carbaldehyde Formula: C16H12BrN3O5 MolecularWeight: 406.18758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C3C(=CC(=C2)Br)C(=O)C(=CO3)C=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C3C(=CC(=C2)Br)C(=O)C(=CO3)C=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN3O5/c1-8-14(20(23)24)9(2)19(18-8)5-10-3-12(17)4-13-15(22)11(6-21)7-25-16(10)13/h3-4,6-7H,5H2,1-2H3