(2-chloranyl-4-cyano-phenyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: (2-chloro-4-cyano-phenyl) 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid (2-chloro-4-cyano-phenyl) ester Formula: C18H15BrClNO4 MolecularWeight: 424.673

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OC2=C(C=C(C=C2)C#N)Cl)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OC2=C(C=C(C=C2)C#N)Cl)OC

InChI

InChI=1S/C18H15BrClNO4/c1-3-6-24-17-13(19)8-12(9-16(17)23-2)18(22)25-15-5-4-11(10-21)7-14(15)20/h4-5,7-9H,3,6H2,1-2H3