[1-[2-[2-(azidomethyl)-4,5-dimethoxy-phenyl]phenyl]-3-phenyl-prop-2-ynyl] ethanoate

Systemtic Name: [1-[2-[2-(azidomethyl)-4,5-dimethoxy-phenyl]phenyl]-3-phenyl-prop-2-ynyl] ethanoate Openeye Name: [1-[2-[2-(azidomethyl)-4,5-dimethoxy-phenyl]phenyl]-3-phenyl-prop-2-ynyl] acetate CAS Name: acetic acid [1-[2-[2-(azidomethyl)-4,5-dimethoxyphenyl]phenyl]-3-phenylprop-2-ynyl] ester IUPAC Name: [1-[2-[2-(azidomethyl)-4,5-dimethoxyphenyl]phenyl]-3-phenylprop-2-ynyl] acetate Traditional Name: acetic acid [1-[2-[2-(azidomethyl)-4,5-dimethoxy-phenyl]phenyl]-3-phenyl-prop-2-ynyl] ester Formula: C26H23N3O4 MolecularWeight: 441.47852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C#CC1=CC=CC=C1)C2=CC=CC=C2C3=CC(=C(C=C3CN=[N+]=[N-])OC)OC

Isomeric SMILES

CC(=O)OC(C#CC1=CC=CC=C1)C2=CC=CC=C2C3=CC(=C(C=C3CN=[N+]=[N-])OC)OC

InChI

InChI=1S/C26H23N3O4/c1-18(30)33-24(14-13-19-9-5-4-6-10-19)22-12-8-7-11-21(22)23-16-26(32-3)25(31-2)15-20(23)17-28-29-27/h4-12,15-16,24H,17H2,1-3H3