2-[[4-tert-butyl-5-(4-hydroxyphenyl)carbonyl-thiophen-2-yl]methyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[4-tert-butyl-5-(4-hydroxyphenyl)carbonyl-thiophen-2-yl]methyl-methyl-amino]ethanoic acid Openeye Name: 2-[[4-tert-butyl-5-(4-hydroxybenzoyl)-2-thienyl]methyl-methyl-amino]acetic acid CAS Name: 2-[[4-tert-butyl-5-[(4-hydroxyphenyl)-oxomethyl]-2-thiophenyl]methyl-methylamino]acetic acid IUPAC Name: 2-[[4-tert-butyl-5-(4-hydroxybenzoyl)thiophen-2-yl]methyl-methylamino]acetic acid Traditional Name: 2-[[4-tert-butyl-5-(4-hydroxybenzoyl)-2-thienyl]methyl-methyl-amino]acetic acid Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=C1)CN(C)CC(=O)O)C(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CC(C)(C)C1=C(SC(=C1)CN(C)CC(=O)O)C(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C19H23NO4S/c1-19(2,3)15-9-14(10-20(4)11-16(22)23)25-18(15)17(24)12-5-7-13(21)8-6-12/h5-9,21H,10-11H2,1-4H3,(H,22,23)