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

Systemtic Name: tert-butyl 2-[4-[(4-cyanophenyl)carbonylcarbamoylamino]-3-methyl-phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[(4-cyanobenzoyl)carbamoylamino]-3-methyl-phenoxy]acetate CAS Name: 2-[4-[[[[(4-cyanophenyl)-oxomethyl]amino]-oxomethyl]amino]-3-methylphenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(4-cyanobenzoyl)carbamoylamino]-3-methylphenoxy]acetate Traditional Name: 2-[4-[(4-cyanobenzoyl)carbamoylamino]-3-methyl-phenoxy]acetic acid tert-butyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC(C)(C)C)NC(=O)NC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OC(C)(C)C)NC(=O)NC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H23N3O5/c1-14-11-17(29-13-19(26)30-22(2,3)4)9-10-18(14)24-21(28)25-20(27)16-7-5-15(12-23)6-8-16/h5-11H,13H2,1-4H3,(H2,24,25,27,28)