(4-oxidanylidene-4-thiophen-2-yl-butyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 4-(tert-butoxycarbonylamino)benzoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 4-(tert-butoxycarbonylamino)benzoic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C20H23NO5S/c1-20(2,3)26-19(24)21-15-10-8-14(9-11-15)18(23)25-12-4-6-16(22)17-7-5-13-27-17/h5,7-11,13H,4,6,12H2,1-3H3,(H,21,24)