[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C14H9Br2NO5S MolecularWeight: 463.09796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C[N+](=O)[O-])OC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])OC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C14H9Br2NO5S/c1-21-11-6-8(4-5-17(19)20)2-3-10(11)22-14(18)12-7-9(15)13(16)23-12/h2-7H,1H3/b5-4+