5-cyclopropyl-1-(3-nitrophenyl)pyrazole-4-carboxylate

Systemtic Name: 5-cyclopropyl-1-(3-nitrophenyl)pyrazole-4-carboxylate Openeye Name: 5-cyclopropyl-1-(3-nitrophenyl)pyrazole-4-carboxylate CAS Name: 5-cyclopropyl-1-(3-nitrophenyl)-4-pyrazolecarboxylate IUPAC Name: 5-cyclopropyl-1-(3-nitrophenyl)pyrazole-4-carboxylate Traditional Name: 5-cyclopropyl-1-(3-nitrophenyl)pyrazole-4-carboxylate Formula: C13H10N3O4- MolecularWeight: 272.2362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CC1C2=C(C=NN2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H11N3O4/c17-13(18)11-7-14-15(12(11)8-4-5-8)9-2-1-3-10(6-9)16(19)20/h1-3,6-8H,4-5H2,(H,17,18)/p-1