(phenylmethyl) N-(5-carbonochloridoylthiophen-3-yl)-N-hexadecyl-carbamate

Systemtic Name: (phenylmethyl) N-(5-carbonochloridoylthiophen-3-yl)-N-hexadecyl-carbamate Openeye Name: benzyl N-(5-chlorocarbonyl-3-thienyl)-N-hexadecyl-carbamate CAS Name: N-(5-carbonochloridoyl-3-thiophenyl)-N-hexadecylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(5-carbonochloridoylthiophen-3-yl)-N-hexadecylcarbamate Traditional Name: N-cetyl-N-(5-chlorocarbonyl-3-thienyl)carbamic acid benzyl ester Formula: C29H42ClNO3S MolecularWeight: 520.16668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H42ClNO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-31(26-22-27(28(30)32)35-24-26)29(33)34-23-25-19-16-15-17-20-25/h15-17,19-20,22,24H,2-14,18,21,23H2,1H3