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

Systemtic Name: oct-3-ynyl N-[[(E)-3-(2-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]carbamate Openeye Name: oct-3-ynyl 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 oct-3-ynyl ester IUPAC Name: oct-3-ynyl 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 oct-3-ynyl ester Formula: C18H20ClFN2O3 MolecularWeight: 366.814403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCCOC(=O)NNC(=O)C=CC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CCCCC#CCCOC(=O)NNC(=O)/C=C/C1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C18H20ClFN2O3/c1-2-3-4-5-6-7-12-25-18(24)22-21-17(23)11-9-14-8-10-15(20)13-16(14)19/h8-11,13H,2-4,7,12H2,1H3,(H,21,23)(H,22,24)/b11-9+