N-phenylmethoxy-5-[2-[3-(phenylsulfonyl)prop-1-ynyl]phenyl]pent-4-yn-1-imine

Systemtic Name: N-phenylmethoxy-5-[2-[3-(phenylsulfonyl)prop-1-ynyl]phenyl]pent-4-yn-1-imine Openeye Name: 5-[2-[3-(benzenesulfonyl)prop-1-ynyl]phenyl]-N-benzyloxy-pent-4-yn-1-imine CAS Name: 5-[2-[3-(benzenesulfonyl)prop-1-ynyl]phenyl]-N-phenylmethoxy-4-pentyn-1-imine IUPAC Name: 5-[2-[3-(benzenesulfonyl)prop-1-ynyl]phenyl]-N-phenylmethoxypent-4-yn-1-imine Traditional Name: (E)-benzoxy-[5-[2-(3-besylprop-1-ynyl)phenyl]pent-4-ynylidene]amine Formula: C27H23NO3S MolecularWeight: 441.54142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CON=CCCC#CC2=CC=CC=C2C#CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CO/N=C/CCC#CC2=CC=CC=C2C#CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H23NO3S/c29-32(30,27-19-7-2-8-20-27)22-12-18-26-17-10-9-16-25(26)15-6-3-11-21-28-31-23-24-13-4-1-5-14-24/h1-2,4-5,7-10,13-14,16-17,19-21H,3,11,22-23H2/b28-21+