5-azanyl-1-(3-nitrophenyl)carbonyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(3-nitrophenyl)carbonyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(3-nitrobenzoyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-[(3-nitrophenyl)-oxomethyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(3-nitrobenzoyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(3-nitrobenzoyl)pyrazole-4-carbonitrile Formula: C11H7N5O3 MolecularWeight: 257.20498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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