methyl N-oct-1-ynyl-N-(phenylmethyl)carbamate

Systemtic Name: methyl N-oct-1-ynyl-N-(phenylmethyl)carbamate Openeye Name: methyl N-benzyl-N-oct-1-ynyl-carbamate CAS Name: N-oct-1-ynyl-N-(phenylmethyl)carbamic acid methyl ester IUPAC Name: methyl N-benzyl-N-oct-1-ynylcarbamate Traditional Name: N-benzyl-N-oct-1-ynyl-carbamic acid methyl ester Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CN(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCC#CN(CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H23NO2/c1-3-4-5-6-7-11-14-18(17(19)20-2)15-16-12-9-8-10-13-16/h8-10,12-13H,3-7,15H2,1-2H3