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

Systemtic Name: [2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl] 4-cyanobenzoate Openeye Name: [2-(4-anilino-N-isopropyl-anilino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(4-anilino-N-isopropyl-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=C(C=C1)NC2=CC=CC=C2)C(=O)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)COC(=O)C3=CC=C(C=C3)C#N

InChI

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