1-phenylnon-4-yn-3-yl N-diazocarbamate

Systemtic Name: 1-phenylnon-4-yn-3-yl N-diazocarbamate Openeye Name: 1-phenethylhept-2-ynyl N-diazocarbamate CAS Name: N-diazocarbamic acid 1-phenylnon-4-yn-3-yl ester IUPAC Name: 1-phenylnon-4-yn-3-yl N-diazocarbamate Traditional Name: N-diazocarbamic acid 1-phenethylhept-2-ynyl ester Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(CCC1=CC=CC=C1)OC(=O)N=[N+]=[N-]

Isomeric SMILES

CCCCC#CC(CCC1=CC=CC=C1)OC(=O)N=[N+]=[N-]

InChI

InChI=1S/C16H19N3O2/c1-2-3-4-8-11-15(21-16(20)18-19-17)13-12-14-9-6-5-7-10-14/h5-7,9-10,15H,2-4,12-13H2,1H3