5-chloranyl-7-[(2-methoxy-5-nitro-phenoxy)methyl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 5-chloranyl-7-[(2-methoxy-5-nitro-phenoxy)methyl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 5-chloro-7-[(2-methoxy-5-nitro-phenoxy)methyl]-2,3-dihydro-1,4-benzodioxine CAS Name: 5-chloro-7-[(2-methoxy-5-nitrophenoxy)methyl]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 5-chloro-7-[(2-methoxy-5-nitrophenoxy)methyl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 5-chloro-7-[(2-methoxy-5-nitro-phenoxy)methyl]-2,3-dihydro-1,4-benzodioxin Formula: C16H14ClNO6 MolecularWeight: 351.73846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C16H14ClNO6/c1-21-13-3-2-11(18(19)20)8-14(13)24-9-10-6-12(17)16-15(7-10)22-4-5-23-16/h2-3,6-8H,4-5,9H2,1H3