[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=C[N+](=O)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=C(C=C(C=C2)/C=C/[N+](=O)[O-])OC)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O7/c1-11-9-13(4-5-14(11)19(23)24)17(20)26-15-6-3-12(7-8-18(21)22)10-16(15)25-2/h3-10H,1-2H3/b8-7+