5-[3-[(4-tert-butylphenyl)methylamino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[(4-tert-butylphenyl)methylamino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[(4-tert-butylphenyl)methylamino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[(4-tert-butylphenyl)methylamino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[(4-tert-butylphenyl)methylamino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[(4-tert-butylbenzyl)amino]propyl]-2-thenoic acid Formula: C19H25NO2S MolecularWeight: 331.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNCCCC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNCCCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C19H25NO2S/c1-19(2,3)15-8-6-14(7-9-15)13-20-12-4-5-16-10-11-17(23-16)18(21)22/h6-11,20H,4-5,12-13H2,1-3H3,(H,21,22)