ethyl 2-[4-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]pyrimidin-5-yl]ethanoate

Systemtic Name: ethyl 2-[4-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-[4-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]pyrimidin-5-yl]acetate CAS Name: 2-[4-chloro-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-5-pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]pyrimidin-5-yl]acetate Traditional Name: 2-[4-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]pyrimidin-5-yl]acetic acid ethyl ester Formula: C14H12ClN3O5 MolecularWeight: 337.71518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CN=C(N=C1Cl)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=CN=C(N=C1Cl)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H12ClN3O5/c1-2-22-13(19)7-9-8-16-11(17-14(9)15)5-3-10-4-6-12(23-10)18(20)21/h3-6,8H,2,7H2,1H3/b5-3+