ethyl N-[(E)-[3-(5-nitrofuran-2-yl)-1-propan-2-yl-pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: ethyl N-[(E)-[3-(5-nitrofuran-2-yl)-1-propan-2-yl-pyrazol-4-yl]methylideneamino]carbamate Openeye Name: ethyl N-[(E)-[1-isopropyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]carbamate CAS Name: N-[(E)-[3-(5-nitro-2-furanyl)-1-propan-2-yl-4-pyrazolyl]methylideneamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-[3-(5-nitrofuran-2-yl)-1-propan-2-ylpyrazol-4-yl]methylideneamino]carbamate Traditional Name: N-[(E)-[1-isopropyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]carbamic acid ethyl ester Formula: C14H17N5O5 MolecularWeight: 335.31528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCOC(=O)N/N=C/C1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C14H17N5O5/c1-4-23-14(20)16-15-7-10-8-18(9(2)3)17-13(10)11-5-6-12(24-11)19(21)22/h5-9H,4H2,1-3H3,(H,16,20)/b15-7+