(phenylmethyl) N-(4-carbonochloridoylphenyl)-N-hexadecyl-carbamate

Systemtic Name: (phenylmethyl) N-(4-carbonochloridoylphenyl)-N-hexadecyl-carbamate Openeye Name: benzyl N-(4-chlorocarbonylphenyl)-N-hexadecyl-carbamate CAS Name: N-(4-carbonochloridoylphenyl)-N-hexadecylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-carbonochloridoylphenyl)-N-hexadecylcarbamate Traditional Name: N-cetyl-N-(4-chlorocarbonylphenyl)carbamic acid benzyl ester Formula: C31H44ClNO3 MolecularWeight: 514.13896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H44ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-33(29-23-21-28(22-24-29)30(32)34)31(35)36-26-27-19-16-15-17-20-27/h15-17,19-24H,2-14,18,25-26H2,1H3