diethyl (E)-but-2-enedioate; 1-methyl-4-nitro-benzene

Systemtic Name: diethyl (E)-but-2-enedioate; 1-methyl-4-nitro-benzene Openeye Name: diethyl (E)-but-2-enedioate; 1-methyl-4-nitro-benzene CAS Name: (E)-2-butenedioic acid diethyl ester; 1-methyl-4-nitrobenzene IUPAC Name: diethyl (E)-but-2-enedioate; 1-methyl-4-nitrobenzene Traditional Name: (E)-but-2-enedioic acid diethyl ester; 1-methyl-4-nitro-benzene Formula: C15H19NO6 MolecularWeight: 309.31446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC.CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC.CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H12O4.C7H7NO2/c1-3-11-7(9)5-6-8(10)12-4-2;1-6-2-4-7(5-3-6)8(9)10/h5-6H,3-4H2,1-2H3;2-5H,1H3/b6-5+;