2-[3-(ethoxycarbonylamino)-4-ethoxycarbonyloxycarbonyl-thiophen-2-yl]pentanoic acid

Systemtic Name: 2-[3-(ethoxycarbonylamino)-4-ethoxycarbonyloxycarbonyl-thiophen-2-yl]pentanoic acid Openeye Name: 2-[3-(ethoxycarbonylamino)-4-ethoxycarbonyloxycarbonyl-2-thienyl]pentanoic acid CAS Name: 2-[3-(ethoxycarbonylamino)-4-[ethoxycarbonyloxy(oxo)methyl]-2-thiophenyl]pentanoic acid IUPAC Name: 2-[3-(ethoxycarbonylamino)-4-ethoxycarbonyloxycarbonylthiophen-2-yl]pentanoic acid Traditional Name: 2-[3-(carbethoxyamino)-4-carbethoxyoxycarbonyl-2-thienyl]valeric acid Formula: C16H21NO8S MolecularWeight: 387.40484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C(=CS1)C(=O)OC(=O)OCC)NC(=O)OCC)C(=O)O

Isomeric SMILES

CCCC(C1=C(C(=CS1)C(=O)OC(=O)OCC)NC(=O)OCC)C(=O)O

InChI

InChI=1S/C16H21NO8S/c1-4-7-9(13(18)19)12-11(17-15(21)23-5-2)10(8-26-12)14(20)25-16(22)24-6-3/h8-9H,4-7H2,1-3H3,(H,17,21)(H,18,19)