7-bromanyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]chromen-2-one Openeye Name: 7-bromo-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]chromen-2-one CAS Name: 7-bromo-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]chromen-2-one Traditional Name: 7-bromo-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]coumarin Formula: C15H12BrN3O4 MolecularWeight: 378.17748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=O)OC3=C2C=CC(=C3)Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=O)OC3=C2C=CC(=C3)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN3O4/c1-8-15(19(21)22)9(2)18(17-8)7-10-5-14(20)23-13-6-11(16)3-4-12(10)13/h3-6H,7H2,1-2H3