butyl 4-[1-(2,6-dimethylphenoxy)propan-2-ylcarbamoylamino]benzoate

Systemtic Name: butyl 4-[1-(2,6-dimethylphenoxy)propan-2-ylcarbamoylamino]benzoate Openeye Name: butyl 4-[[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]carbamoylamino]benzoate CAS Name: 4-[[[1-(2,6-dimethylphenoxy)propan-2-ylamino]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[1-(2,6-dimethylphenoxy)propan-2-ylcarbamoylamino]benzoate Traditional Name: 4-[[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]carbamoylamino]benzoic acid butyl ester Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC(C)COC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC(C)COC2=C(C=CC=C2C)C

InChI

InChI=1S/C23H30N2O4/c1-5-6-14-28-22(26)19-10-12-20(13-11-19)25-23(27)24-18(4)15-29-21-16(2)8-7-9-17(21)3/h7-13,18H,5-6,14-15H2,1-4H3,(H2,24,25,27)