tert-butyl N-hexadecyl-N-(4-imidazol-1-ylcarbonylphenyl)carbamate

Systemtic Name: tert-butyl N-hexadecyl-N-(4-imidazol-1-ylcarbonylphenyl)carbamate Openeye Name: tert-butyl N-hexadecyl-N-[4-(imidazole-1-carbonyl)phenyl]carbamate CAS Name: N-hexadecyl-N-[4-[1-imidazolyl(oxo)methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-hexadecyl-N-[4-(imidazole-1-carbonyl)phenyl]carbamate Traditional Name: N-cetyl-N-[4-(imidazole-1-carbonyl)phenyl]carbamic acid tert-butyl ester Formula: C31H49N3O3 MolecularWeight: 511.73906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(C1=CC=C(C=C1)C(=O)N2C=CN=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN(C1=CC=C(C=C1)C(=O)N2C=CN=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H49N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-34(30(36)37-31(2,3)4)28-21-19-27(20-22-28)29(35)33-25-23-32-26-33/h19-23,25-26H,5-18,24H2,1-4H3