1-[(E)-4,4-dimethoxy-2-methyl-but-2-enyl]-2-nitro-benzene

Systemtic Name: 1-[(E)-4,4-dimethoxy-2-methyl-but-2-enyl]-2-nitro-benzene Openeye Name: 1-[(E)-4,4-dimethoxy-2-methyl-but-2-enyl]-2-nitro-benzene CAS Name: 1-[(E)-4,4-dimethoxy-2-methylbut-2-enyl]-2-nitrobenzene IUPAC Name: 1-[(E)-4,4-dimethoxy-2-methylbut-2-enyl]-2-nitrobenzene Traditional Name: 1-[(E)-4,4-dimethoxy-2-methyl-but-2-enyl]-2-nitro-benzene Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(OC)OC)CC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C(OC)OC)/CC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H17NO4/c1-10(9-13(17-2)18-3)8-11-6-4-5-7-12(11)14(15)16/h4-7,9,13H,8H2,1-3H3/b10-9+