(4-cyanophenyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: (4-cyanophenyl) 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: (4-cyanophenyl) 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid (4-cyanophenyl) ester Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrNO4/c1-3-8-23-17-15(19)9-13(10-16(17)22-2)18(21)24-14-6-4-12(11-20)5-7-14/h4-7,9-10H,3,8H2,1-2H3