[2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [2-(3,4-difluoroanilino)-2-oxo-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-2-propenoic acid [2-(3,4-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluoroanilino)-2-oxoethyl] (E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)acrylic acid [2-(3,4-difluoroanilino)-2-keto-ethyl] ester Formula: C21H21F2NO5 MolecularWeight: 405.391946

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC2=CC(=C(C=C2)F)F)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC(=C(C=C2)F)F)OC

InChI

InChI=1S/C21H21F2NO5/c1-3-10-28-18-8-4-14(11-19(18)27-2)5-9-21(26)29-13-20(25)24-15-6-7-16(22)17(23)12-15/h4-9,11-12H,3,10,13H2,1-2H3,(H,24,25)/b9-5+