(2-butan-2-yl-4,6-dinitro-phenyl) (E)-2-methylbut-2-enoate

Systemtic Name: (2-butan-2-yl-4,6-dinitro-phenyl) (E)-2-methylbut-2-enoate Openeye Name: (2,4-dinitro-6-sec-butyl-phenyl) (E)-2-methylbut-2-enoate CAS Name: (E)-2-methyl-2-butenoic acid (2-butan-2-yl-4,6-dinitrophenyl) ester IUPAC Name: (2-butan-2-yl-4,6-dinitrophenyl) (E)-2-methylbut-2-enoate Traditional Name: (E)-2-methylbut-2-enoic acid (2,4-dinitro-6-sec-butyl-phenyl) ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O6/c1-5-9(3)12-7-11(16(19)20)8-13(17(21)22)14(12)23-15(18)10(4)6-2/h6-9H,5H2,1-4H3/b10-6+