O4-tert-butyl O2-octyl 5-azanyl-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-tert-butyl O2-octyl 5-azanyl-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-tert-butyl O2-octyl 5-amino-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-methylthiophene-2,4-dicarboxylic acid O4-tert-butyl ester O2-octyl ester IUPAC Name: 4-O-tert-butyl 2-O-octyl 5-amino-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-methyl-thiophene-2,4-dicarboxylic acid O4-tert-butyl ester O2-octyl ester Formula: C19H31NO4S MolecularWeight: 369.51874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(C(=C(S1)N)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(C(=C(S1)N)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H31NO4S/c1-6-7-8-9-10-11-12-23-18(22)15-13(2)14(16(20)25-15)17(21)24-19(3,4)5/h6-12,20H2,1-5H3