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

Systemtic Name: [2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [2-(2-fluoroanilino)-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-(2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-fluoroanilino)-2-oxoethyl] (E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)acrylic acid [2-(2-fluoroanilino)-2-keto-ethyl] ester Formula: C21H22FNO5 MolecularWeight: 387.401483

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC2=CC=CC=C2F)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC=CC=C2F)OC

InChI

InChI=1S/C21H22FNO5/c1-3-12-27-18-10-8-15(13-19(18)26-2)9-11-21(25)28-14-20(24)23-17-7-5-4-6-16(17)22/h4-11,13H,3,12,14H2,1-2H3,(H,23,24)/b11-9+