3-(3-methylpyrazol-1-yl)carbonyl-6-nitro-chromen-2-one

Systemtic Name: 3-(3-methylpyrazol-1-yl)carbonyl-6-nitro-chromen-2-one Openeye Name: 3-(3-methylpyrazole-1-carbonyl)-6-nitro-chromen-2-one CAS Name: 3-[(3-methyl-1-pyrazolyl)-oxomethyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-(3-methylpyrazole-1-carbonyl)-6-nitrochromen-2-one Traditional Name: 3-(3-methylpyrazole-1-carbonyl)-6-nitro-coumarin Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)C(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC1=NN(C=C1)C(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C14H9N3O5/c1-8-4-5-16(15-8)13(18)11-7-9-6-10(17(20)21)2-3-12(9)22-14(11)19/h2-7H,1H3