7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1-benzofuran-5-carboxylic acid

Systemtic Name: 7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1-benzofuran-5-carboxylic acid Openeye Name: 7-(4-tert-butoxycarbonylpiperazin-1-yl)benzofuran-5-carboxylic acid CAS Name: 7-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-5-benzofurancarboxylic acid IUPAC Name: 7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1-benzofuran-5-carboxylic acid Traditional Name: 7-(4-tert-butoxycarbonylpiperazino)benzofuran-5-carboxylic acid Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C(=CC(=C2)C(=O)O)C=CO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C(=CC(=C2)C(=O)O)C=CO3

InChI

InChI=1S/C18H22N2O5/c1-18(2,3)25-17(23)20-7-5-19(6-8-20)14-11-13(16(21)22)10-12-4-9-24-15(12)14/h4,9-11H,5-8H2,1-3H3,(H,21,22)