4-[[4-(4-tert-butylphenyl)-5-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(4-tert-butylphenyl)-5-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(4-tert-butylphenyl)-3-isopropoxycarbonyl-5-methyl-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[4-(4-tert-butylphenyl)-5-methyl-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(4-tert-butylphenyl)-5-methyl-3-propan-2-yloxycarbonylthiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[4-(4-tert-butylphenyl)-3-isopropoxycarbonyl-5-methyl-2-thienyl]amino]-4-keto-butyric acid Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCC(=O)O)C(=O)OC(C)C)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCC(=O)O)C(=O)OC(C)C)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H29NO5S/c1-13(2)29-22(28)20-19(15-7-9-16(10-8-15)23(4,5)6)14(3)30-21(20)24-17(25)11-12-18(26)27/h7-10,13H,11-12H2,1-6H3,(H,24,25)(H,26,27)