[(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-propoxyphenoxy)ethanoate

Systemtic Name: [(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-propoxyphenoxy)ethanoate Openeye Name: [(1R)-2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-(2-propoxyphenoxy)acetate CAS Name: 2-(2-propoxyphenoxy)acetic acid [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl] 2-(2-propoxyphenoxy)acetate Traditional Name: 2-(2-propoxyphenoxy)acetic acid [(1R)-2-(4-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1OCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCOC1=CC=CC=C1OCC(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H22N2O5/c1-3-12-26-18-6-4-5-7-19(18)27-14-20(24)28-15(2)21(25)23-17-10-8-16(13-22)9-11-17/h4-11,15H,3,12,14H2,1-2H3,(H,23,25)/t15-/m1/s1