2-[(5-tert-butyl-2-ethanoyl-thiophen-3-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(5-tert-butyl-2-ethanoyl-thiophen-3-yl)carbamoyl]benzoic acid Openeye Name: 2-[(2-acetyl-5-tert-butyl-3-thienyl)carbamoyl]benzoic acid CAS Name: 2-[[(2-acetyl-5-tert-butyl-3-thiophenyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(2-acetyl-5-tert-butylthiophen-3-yl)carbamoyl]benzoic acid Traditional Name: 2-[(2-acetyl-5-tert-butyl-3-thienyl)carbamoyl]benzoic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(S1)C(C)(C)C)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=O)C1=C(C=C(S1)C(C)(C)C)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H19NO4S/c1-10(20)15-13(9-14(24-15)18(2,3)4)19-16(21)11-7-5-6-8-12(11)17(22)23/h5-9H,1-4H3,(H,19,21)(H,22,23)