4-hexyl-2-(octoxycarbonylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-hexyl-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Openeye Name: 4-hexyl-2-(octoxycarbonylamino)thiophene-3-carboxylic acid CAS Name: 4-hexyl-2-[[octoxy(oxo)methyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-hexyl-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Traditional Name: 4-hexyl-2-(octoxycarbonylamino)-3-thenoic acid Formula: C20H33NO4S MolecularWeight: 383.54532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)NC1=C(C(=CS1)CCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)NC1=C(C(=CS1)CCCCCC)C(=O)O

InChI

InChI=1S/C20H33NO4S/c1-3-5-7-9-10-12-14-25-20(24)21-18-17(19(22)23)16(15-26-18)13-11-8-6-4-2/h15H,3-14H2,1-2H3,(H,21,24)(H,22,23)