2-hydroxyethyl 5-[4-[ethanoyl-[4-(1-oxidanylhexyl)phenyl]amino]butyl]thiophene-2-carboxylate

Systemtic Name: 2-hydroxyethyl 5-[4-[ethanoyl-[4-(1-oxidanylhexyl)phenyl]amino]butyl]thiophene-2-carboxylate Openeye Name: 2-hydroxyethyl 5-[4-[N-acetyl-4-(1-hydroxyhexyl)anilino]butyl]thiophene-2-carboxylate CAS Name: 5-[4-[N-acetyl-4-(1-hydroxyhexyl)anilino]butyl]-2-thiophenecarboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 5-[4-[N-acetyl-4-(1-hydroxyhexyl)anilino]butyl]thiophene-2-carboxylate Traditional Name: 5-[4-[N-acetyl-4-(1-hydroxyhexyl)anilino]butyl]thiophene-2-carboxylic acid 2-hydroxyethyl ester Formula: C25H35NO5S MolecularWeight: 461.6141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)N(CCCCC2=CC=C(S2)C(=O)OCCO)C(=O)C)O

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)N(CCCCC2=CC=C(S2)C(=O)OCCO)C(=O)C)O

InChI

InChI=1S/C25H35NO5S/c1-3-4-5-9-23(29)20-10-12-21(13-11-20)26(19(2)28)16-7-6-8-22-14-15-24(32-22)25(30)31-18-17-27/h10-15,23,27,29H,3-9,16-18H2,1-2H3