4-phenylbutyl N-[[(E)-3-(2-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]carbamate

Systemtic Name: 4-phenylbutyl N-[[(E)-3-(2-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]carbamate Openeye Name: 4-phenylbutyl N-[[(E)-3-(2-chloro-4-fluoro-phenyl)prop-2-enoyl]amino]carbamate CAS Name: N-[[(E)-3-(2-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]amino]carbamic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl N-[[(E)-3-(2-chloro-4-fluorophenyl)prop-2-enoyl]amino]carbamate Traditional Name: N-[[(E)-3-(2-chloro-4-fluoro-phenyl)acryloyl]amino]carbamic acid 4-phenylbutyl ester Formula: C20H20ClFN2O3 MolecularWeight: 390.835803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC(=O)NNC(=O)C=CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC(=O)NNC(=O)/C=C/C2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C20H20ClFN2O3/c21-18-14-17(22)11-9-16(18)10-12-19(25)23-24-20(26)27-13-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-12,14H,4-5,8,13H2,(H,23,25)(H,24,26)/b12-10+