hexadecyl N-(2-bromanyl-4-methyl-phenyl)carbamate

Systemtic Name: hexadecyl N-(2-bromanyl-4-methyl-phenyl)carbamate Openeye Name: hexadecyl N-(2-bromo-4-methyl-phenyl)carbamate CAS Name: N-(2-bromo-4-methylphenyl)carbamic acid hexadecyl ester IUPAC Name: hexadecyl N-(2-bromo-4-methylphenyl)carbamate Traditional Name: N-(2-bromo-4-methyl-phenyl)carbamic acid cetyl ester Formula: C24H40BrNO2 MolecularWeight: 454.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)NC1=C(C=C(C=C1)C)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)NC1=C(C=C(C=C1)C)Br

InChI

InChI=1S/C24H40BrNO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-24(27)26-23-18-17-21(2)20-22(23)25/h17-18,20H,3-16,19H2,1-2H3,(H,26,27)