tert-butyl 2-[3-[(4-cyanophenyl)carbonylcarbamoylamino]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[3-[(4-cyanophenyl)carbonylcarbamoylamino]phenoxy]ethanoate Openeye Name: tert-butyl 2-[3-[(4-cyanobenzoyl)carbamoylamino]phenoxy]acetate CAS Name: 2-[3-[[[[(4-cyanophenyl)-oxomethyl]amino]-oxomethyl]amino]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[(4-cyanobenzoyl)carbamoylamino]phenoxy]acetate Traditional Name: 2-[3-[(4-cyanobenzoyl)carbamoylamino]phenoxy]acetic acid tert-butyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=CC(=C1)NC(=O)NC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=CC(=C1)NC(=O)NC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H21N3O5/c1-21(2,3)29-18(25)13-28-17-6-4-5-16(11-17)23-20(27)24-19(26)15-9-7-14(12-22)8-10-15/h4-11H,13H2,1-3H3,(H2,23,24,26,27)