1,3,5-trimethoxy-2-[(E)-3-nitrobut-2-en-2-yl]benzene

Systemtic Name: 1,3,5-trimethoxy-2-[(E)-3-nitrobut-2-en-2-yl]benzene Openeye Name: 1,3,5-trimethoxy-2-[(E)-1-methyl-2-nitro-prop-1-enyl]benzene CAS Name: 1,3,5-trimethoxy-2-[(E)-3-nitrobut-2-en-2-yl]benzene IUPAC Name: 1,3,5-trimethoxy-2-[(E)-3-nitrobut-2-en-2-yl]benzene Traditional Name: 1,3,5-trimethoxy-2-[(E)-1-methyl-2-nitro-prop-1-enyl]benzene Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)[N+](=O)[O-])C1=C(C=C(C=C1OC)OC)OC

Isomeric SMILES

C/C(=C(/C)\[N+](=O)[O-])/C1=C(C=C(C=C1OC)OC)OC

InChI

InChI=1S/C13H17NO5/c1-8(9(2)14(15)16)13-11(18-4)6-10(17-3)7-12(13)19-5/h6-7H,1-5H3/b9-8+