[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3,4-bis(chloranyl)benzoate

Systemtic Name: [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3,4-bis(chloranyl)benzoate Openeye Name: [2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] 3,4-dichlorobenzoate CAS Name: 3,4-dichlorobenzoic acid [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3,4-dichlorobenzoate Traditional Name: 3,4-dichlorobenzoic acid [2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C21H15Cl2NO3 MolecularWeight: 400.2547

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=CC=NC=C2)OC(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C2=CC=NC=C2)OC(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H15Cl2NO3/c1-26-20-12-15(3-2-14-8-10-24-11-9-14)4-7-19(20)27-21(25)16-5-6-17(22)18(23)13-16/h2-13H,1H3/b3-2+