6-[(E)-2-(4-methoxy-3-prop-2-ynoxy-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(E)-2-(4-methoxy-3-prop-2-ynoxy-phenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[(E)-2-(4-methoxy-3-prop-2-ynoxy-phenyl)vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[(E)-2-(4-methoxy-3-prop-2-ynoxyphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(E)-2-(4-methoxy-3-prop-2-ynoxyphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[(E)-2-(4-methoxy-3-propargyloxy-phenyl)vinyl]-5-nitro-uracil Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC#C

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC#C

InChI

InChI=1S/C16H13N3O6/c1-3-8-25-13-9-10(5-7-12(13)24-2)4-6-11-14(19(22)23)15(20)18-16(21)17-11/h1,4-7,9H,8H2,2H3,(H2,17,18,20,21)/b6-4+