methyl 3-[2-(4-tert-butylphenoxy)propanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-(4-tert-butylphenoxy)propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[2-(4-tert-butylphenoxy)propanoylamino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-(4-tert-butylphenoxy)-1-oxopropyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-tert-butylphenoxy)propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[2-(4-tert-butylphenoxy)propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)OC)C1=CC=CS1)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC(CC(=O)OC)C1=CC=CS1)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H27NO4S/c1-14(26-16-10-8-15(9-11-16)21(2,3)4)20(24)22-17(13-19(23)25-5)18-7-6-12-27-18/h6-12,14,17H,13H2,1-5H3,(H,22,24)