5-azanyl-1-(2-nitrophenyl)carbonyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2-nitrophenyl)carbonyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2-nitrobenzoyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-[(2-nitrophenyl)-oxomethyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-nitrobenzoyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(2-nitrobenzoyl)pyrazole-4-carbonitrile Formula: C11H7N5O3 MolecularWeight: 257.20498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N2C(=C(C=N2)C#N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N2C(=C(C=N2)C#N)N)[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O3/c12-5-7-6-14-15(10(7)13)11(17)8-3-1-2-4-9(8)16(18)19/h1-4,6H,13H2