hexyl 4-[3-(4-tert-butylphenyl)propanoylamino]benzoate

Systemtic Name: hexyl 4-[3-(4-tert-butylphenyl)propanoylamino]benzoate Openeye Name: hexyl 4-[3-(4-tert-butylphenyl)propanoylamino]benzoate CAS Name: 4-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[3-(4-tert-butylphenyl)propanoylamino]benzoate Traditional Name: 4-[3-(4-tert-butylphenyl)propanoylamino]benzoic acid hexyl ester Formula: C26H35NO3 MolecularWeight: 409.561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C26H35NO3/c1-5-6-7-8-19-30-25(29)21-12-16-23(17-13-21)27-24(28)18-11-20-9-14-22(15-10-20)26(2,3)4/h9-10,12-17H,5-8,11,18-19H2,1-4H3,(H,27,28)