1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene

Systemtic Name: 1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene Openeye Name: 1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene CAS Name: 1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene IUPAC Name: 1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene Traditional Name: 1-butyl-2,5-dimethoxy-4-[(E)-2-nitrobut-1-enyl]benzene Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C(=C1)OC)C=C(CC)[N+](=O)[O-])OC

Isomeric SMILES

CCCCC1=C(C=C(C(=C1)OC)/C=C(\CC)/[N+](=O)[O-])OC

InChI

InChI=1S/C16H23NO4/c1-5-7-8-12-10-16(21-4)13(11-15(12)20-3)9-14(6-2)17(18)19/h9-11H,5-8H2,1-4H3/b14-9+