2-azanyl-5-dodecyl-thiophene-3-carboxylic acid

Systemtic Name: 2-azanyl-5-dodecyl-thiophene-3-carboxylic acid Openeye Name: 2-amino-5-dodecyl-thiophene-3-carboxylic acid CAS Name: 2-amino-5-dodecyl-3-thiophenecarboxylic acid IUPAC Name: 2-amino-5-dodecylthiophene-3-carboxylic acid Traditional Name: 2-amino-5-lauryl-3-thenoic acid Formula: C17H29NO2S MolecularWeight: 311.48266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(S1)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(S1)N)C(=O)O

InChI

InChI=1S/C17H29NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15(17(19)20)16(18)21-14/h13H,2-12,18H2,1H3,(H,19,20)