tert-butyl 2-(octoxycarbonylamino)-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: tert-butyl 2-(octoxycarbonylamino)-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: tert-butyl 5-isopropyl-2-(octoxycarbonylamino)thiophene-3-carboxylate CAS Name: 2-[[octoxy(oxo)methyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(octoxycarbonylamino)-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-(octoxycarbonylamino)thiophene-3-carboxylic acid tert-butyl ester Formula: C21H35NO4S MolecularWeight: 397.5719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)NC1=C(C=C(S1)C(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCOC(=O)NC1=C(C=C(S1)C(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H35NO4S/c1-7-8-9-10-11-12-13-25-20(24)22-18-16(14-17(27-18)15(2)3)19(23)26-21(4,5)6/h14-15H,7-13H2,1-6H3,(H,22,24)