5-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3-ethoxycarbonyl-4-phenyl-2-thienyl)amino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[(3-ethoxycarbonyl-4-phenyl-2-thiophenyl)amino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[(3-ethoxycarbonyl-4-phenylthiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[(3-carbethoxy-4-phenyl-2-thienyl)amino]-5-keto-3,3-dimethyl-valeric acid Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C20H23NO5S/c1-4-26-19(25)17-14(13-8-6-5-7-9-13)12-27-18(17)21-15(22)10-20(2,3)11-16(23)24/h5-9,12H,4,10-11H2,1-3H3,(H,21,22)(H,23,24)