[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] (E)-3-(3-fluorophenyl)prop-2-enoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] (E)-3-(3-fluorophenyl)prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate CAS Name: (E)-3-(3-fluorophenyl)-2-propenoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] (E)-3-(3-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluorophenyl)acrylic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C17H16FNO3S MolecularWeight: 333.377243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C=CC2=CC(=CC=C2)F

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)/C=C/C2=CC(=CC=C2)F

InChI

InChI=1S/C17H16FNO3S/c1-12(17(21)19-11-15-6-3-9-23-15)22-16(20)8-7-13-4-2-5-14(18)10-13/h2-10,12H,11H2,1H3,(H,19,21)/b8-7+