1-(bromomethyl)-4-butan-2-yloxy-5-methoxy-2-nitro-benzene

Systemtic Name: 1-(bromomethyl)-4-butan-2-yloxy-5-methoxy-2-nitro-benzene Openeye Name: 1-(bromomethyl)-5-methoxy-2-nitro-4-sec-butoxy-benzene CAS Name: 1-(bromomethyl)-4-butan-2-yloxy-5-methoxy-2-nitrobenzene IUPAC Name: 1-(bromomethyl)-4-butan-2-yloxy-5-methoxy-2-nitrobenzene Traditional Name: 1-(bromomethyl)-5-methoxy-2-nitro-4-sec-butoxy-benzene Formula: C12H16BrNO4 MolecularWeight: 318.16374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C(=C1)[N+](=O)[O-])CBr)OC

Isomeric SMILES

CCC(C)OC1=C(C=C(C(=C1)[N+](=O)[O-])CBr)OC

InChI

InChI=1S/C12H16BrNO4/c1-4-8(2)18-12-6-10(14(15)16)9(7-13)5-11(12)17-3/h5-6,8H,4,7H2,1-3H3