4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole

Systemtic Name: 4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole Openeye Name: 4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole CAS Name: 4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole IUPAC Name: 4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole Traditional Name: 4-methyl-5-[(E)-2-nitroprop-1-enyl]-1,3-benzodioxole Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OCO2)C=C(C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC2=C1OCO2)/C=C(\C)/[N+](=O)[O-]

InChI

InChI=1S/C11H11NO4/c1-7(12(13)14)5-9-3-4-10-11(8(9)2)16-6-15-10/h3-5H,6H2,1-2H3/b7-5+