(4-ethynyl-2,6-dimethyl-heptan-4-yl) N-phenylcarbamate

Systemtic Name: (4-ethynyl-2,6-dimethyl-heptan-4-yl) N-phenylcarbamate Openeye Name: (1-ethynyl-1-isobutyl-3-methyl-butyl) N-phenylcarbamate CAS Name: N-phenylcarbamic acid (4-ethynyl-2,6-dimethylheptan-4-yl) ester IUPAC Name: (4-ethynyl-2,6-dimethylheptan-4-yl) N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 1,1-diisobutylprop-2-ynyl ester Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)(C#C)OC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(CC(C)C)(C#C)OC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C18H25NO2/c1-6-18(12-14(2)3,13-15(4)5)21-17(20)19-16-10-8-7-9-11-16/h1,7-11,14-15H,12-13H2,2-5H3,(H,19,20)