N-(phenylmethyl)-5-[2-(3-prop-2-ynoxyprop-1-ynyl)phenyl]pent-4-yn-1-imine oxide

Systemtic Name: N-(phenylmethyl)-5-[2-(3-prop-2-ynoxyprop-1-ynyl)phenyl]pent-4-yn-1-imine oxide Openeye Name: N-benzyl-5-[2-(3-prop-2-ynoxyprop-1-ynyl)phenyl]pent-4-yn-1-imine oxide CAS Name: N-(phenylmethyl)-5-[2-(3-prop-2-ynoxyprop-1-ynyl)phenyl]-4-pentyn-1-imine oxide IUPAC Name: N-benzyl-5-[2-(3-prop-2-ynoxyprop-1-ynyl)phenyl]pent-4-yn-1-imine oxide Traditional Name: N-benzyl-5-[2-(3-propargyloxyprop-1-ynyl)phenyl]pent-4-yn-1-imine oxide Formula: C24H21NO2 MolecularWeight: 355.42904

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOCC#CC1=CC=CC=C1C#CCCC=[N+](CC2=CC=CC=C2)[O-]

Isomeric SMILES

C#CCOCC#CC1=CC=CC=C1C#CCC/C=[N+](/CC2=CC=CC=C2)\[O-]

InChI

InChI=1S/C24H21NO2/c1-2-19-27-20-11-17-24-16-9-8-15-23(24)14-7-4-10-18-25(26)21-22-12-5-3-6-13-22/h1,3,5-6,8-9,12-13,15-16,18H,4,10,19-21H2/b25-18-