pentyl 4-[3-(4-fluorophenyl)prop-2-enoylamino]benzoate

Systemtic Name: pentyl 4-[3-(4-fluorophenyl)prop-2-enoylamino]benzoate Openeye Name: pentyl 4-[3-(4-fluorophenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[3-(4-fluorophenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(4-fluorophenyl)acryloyl]amino]benzoic acid amyl ester Formula: C21H22FNO3 MolecularWeight: 355.402683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)F

InChI

InChI=1S/C21H22FNO3/c1-2-3-4-15-26-21(25)17-8-12-19(13-9-17)23-20(24)14-7-16-5-10-18(22)11-6-16/h5-14H,2-4,15H2,1H3,(H,23,24)