methyl 3-[2-(2-butan-2-ylphenoxy)ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-(2-butan-2-ylphenoxy)ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-(2-sec-butylphenoxy)acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-(2-butan-2-ylphenoxy)-1-oxoethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-(2-sec-butylphenoxy)acetyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C20H25NO4S/c1-4-14(2)15-8-5-6-9-17(15)25-13-19(22)21-16(12-20(23)24-3)18-10-7-11-26-18/h5-11,14,16H,4,12-13H2,1-3H3,(H,21,22)