[2-oxidanylidene-2-[[4-[phenyl(propan-2-yl)amino]phenyl]amino]ethyl] 4-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-[[4-[phenyl(propan-2-yl)amino]phenyl]amino]ethyl] 4-cyanobenzoate Openeye Name: [2-[4-(N-isopropylanilino)anilino]-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-oxo-2-[4-(N-propan-2-ylanilino)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(N-propan-2-ylanilino)anilino]ethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-[4-(N-isopropylanilino)anilino]-2-keto-ethyl] ester Formula: C25H23N3O3 MolecularWeight: 413.46842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H23N3O3/c1-18(2)28(22-6-4-3-5-7-22)23-14-12-21(13-15-23)27-24(29)17-31-25(30)20-10-8-19(16-26)9-11-20/h3-15,18H,17H2,1-2H3,(H,27,29)