tert-butyl 5-decyl-2-(3-phenoxypropoxycarbonylamino)thiophene-3-carboxylate

Systemtic Name: tert-butyl 5-decyl-2-(3-phenoxypropoxycarbonylamino)thiophene-3-carboxylate Openeye Name: tert-butyl 5-decyl-2-(3-phenoxypropoxycarbonylamino)thiophene-3-carboxylate CAS Name: 5-decyl-2-[[oxo(3-phenoxypropoxy)methyl]amino]-3-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-decyl-2-(3-phenoxypropoxycarbonylamino)thiophene-3-carboxylate Traditional Name: 5-decyl-2-(3-phenoxypropoxycarbonylamino)thiophene-3-carboxylic acid tert-butyl ester Formula: C29H43NO5S MolecularWeight: 517.72042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(S1)NC(=O)OCCCOC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(S1)NC(=O)OCCCOC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H43NO5S/c1-5-6-7-8-9-10-11-15-19-24-22-25(27(31)35-29(2,3)4)26(36-24)30-28(32)34-21-16-20-33-23-17-13-12-14-18-23/h12-14,17-18,22H,5-11,15-16,19-21H2,1-4H3,(H,30,32)