(phenylmethyl) N-(4-carbonochloridoyl-2-fluoranyl-phenyl)-N-hexadecyl-carbamate

Systemtic Name: (phenylmethyl) N-(4-carbonochloridoyl-2-fluoranyl-phenyl)-N-hexadecyl-carbamate Openeye Name: benzyl N-(4-chlorocarbonyl-2-fluoro-phenyl)-N-hexadecyl-carbamate CAS Name: N-(4-carbonochloridoyl-2-fluorophenyl)-N-hexadecylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-carbonochloridoyl-2-fluorophenyl)-N-hexadecylcarbamate Traditional Name: N-cetyl-N-(4-chlorocarbonyl-2-fluoro-phenyl)carbamic acid benzyl ester Formula: C31H43ClFNO3 MolecularWeight: 532.129423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(C1=C(C=C(C=C1)C(=O)Cl)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCN(C1=C(C=C(C=C1)C(=O)Cl)F)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C31H43ClFNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-34(29-22-21-27(30(32)35)24-28(29)33)31(36)37-25-26-19-16-15-17-20-26/h15-17,19-22,24H,2-14,18,23,25H2,1H3