methyl 4-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-3-(3-chloro-4-fluoro-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(3-chloro-4-fluorophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(3-chloro-4-fluoro-phenyl)acryloyl]amino]benzoic acid methyl ester Formula: C17H13ClFNO3 MolecularWeight: 333.741423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H13ClFNO3/c1-23-17(22)12-4-6-13(7-5-12)20-16(21)9-3-11-2-8-15(19)14(18)10-11/h2-10H,1H3,(H,20,21)/b9-3+