methyl 4-fluoranyl-5-imidazol-1-yl-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-fluoranyl-5-imidazol-1-yl-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Openeye Name: methyl 4-fluoro-5-imidazol-1-yl-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoate CAS Name: 4-fluoro-5-(1-imidazolyl)-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-5-imidazol-1-yl-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Traditional Name: 4-fluoro-5-imidazol-1-yl-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid methyl ester Formula: C25H20FN3O3 MolecularWeight: 429.443003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC(=C(C=C1C(=O)OC)N2C=CN=C2)F)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=CC(=C(C=C1C(=O)OC)N2C=CN=C2)F)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H20FN3O3/c1-16(18-8-7-17-5-3-4-6-19(17)12-18)11-24(30)28-22-14-21(26)23(29-10-9-27-15-29)13-20(22)25(31)32-2/h3-15H,1-2H3,(H,28,30)/b16-11-