tert-butyl 5-(6-methoxyheptan-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylate

Systemtic Name: tert-butyl 5-(6-methoxyheptan-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylate Openeye Name: tert-butyl 5-(5-methoxy-1-methyl-hexyl)-2-(octoxycarbonylamino)thiophene-3-carboxylate CAS Name: 5-(6-methoxyheptan-2-yl)-2-[[octoxy(oxo)methyl]amino]-3-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(6-methoxyheptan-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylate Traditional Name: 5-(5-methoxy-1-methyl-hexyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid tert-butyl ester Formula: C26H45NO5S MolecularWeight: 483.7042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H45NO5S/c1-8-9-10-11-12-13-17-31-25(29)27-23-21(24(28)32-26(4,5)6)18-22(33-23)19(2)15-14-16-20(3)30-7/h18-20H,8-17H2,1-7H3,(H,27,29)