7-[[5-ethyl-3-(4-methoxyphenyl)carbonyl-thiophen-2-yl]amino]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[[5-ethyl-3-(4-methoxyphenyl)carbonyl-thiophen-2-yl]amino]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[[5-ethyl-3-(4-methoxybenzoyl)-2-thienyl]amino]-7-oxo-heptanoic acid CAS Name: 7-[[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]amino]-7-oxoheptanoic acid IUPAC Name: 7-[[5-ethyl-3-(4-methoxybenzoyl)thiophen-2-yl]amino]-7-oxoheptanoic acid Traditional Name: 7-[(5-ethyl-3-p-anisoyl-2-thienyl)amino]-7-keto-enanthic acid Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCCCCC(=O)O)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCCCCC(=O)O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25NO5S/c1-3-16-13-17(20(26)14-9-11-15(27-2)12-10-14)21(28-16)22-18(23)7-5-4-6-8-19(24)25/h9-13H,3-8H2,1-2H3,(H,22,23)(H,24,25)