(4-but-3-ynoxy-5-methoxy-2-nitro-phenyl)methanol

Systemtic Name: (4-but-3-ynoxy-5-methoxy-2-nitro-phenyl)methanol Openeye Name: (4-but-3-ynoxy-5-methoxy-2-nitro-phenyl)methanol CAS Name: (4-but-3-ynoxy-5-methoxy-2-nitrophenyl)methanol IUPAC Name: (4-but-3-ynoxy-5-methoxy-2-nitrophenyl)methanol Traditional Name: (4-but-3-ynoxy-5-methoxy-2-nitro-phenyl)methanol Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCCC#C

Isomeric SMILES

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCCC#C

InChI

InChI=1S/C12H13NO5/c1-3-4-5-18-12-7-10(13(15)16)9(8-14)6-11(12)17-2/h1,6-7,14H,4-5,8H2,2H3