tert-butyl N-[3-(1H-imidazol-2-ylcarbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate

Systemtic Name: tert-butyl N-[3-(1H-imidazol-2-ylcarbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate Openeye Name: tert-butyl N-[3-(1H-imidazole-2-carbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate CAS Name: N-[3-[1H-imidazol-2-yl(oxo)methyl]phenyl]-N-[(E)-pentadec-4-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(1H-imidazole-2-carbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamate Traditional Name: N-[3-(1H-imidazole-2-carbonyl)phenyl]-N-[(E)-pentadec-4-enyl]carbamic acid tert-butyl ester Formula: C30H45N3O3 MolecularWeight: 495.6966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CCCCN(C1=CC=CC(=C1)C(=O)C2=NC=CN2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCC/C=C/CCCN(C1=CC=CC(=C1)C(=O)C2=NC=CN2)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H45N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-33(29(35)36-30(2,3)4)26-20-18-19-25(24-26)27(34)28-31-21-22-32-28/h14-15,18-22,24H,5-13,16-17,23H2,1-4H3,(H,31,32)/b15-14+