tert-butyl 3-[4-[(5-cyano-1-benzofuran-2-yl)carbonylamino]cyclohexyl]propanoate

Systemtic Name: tert-butyl 3-[4-[(5-cyano-1-benzofuran-2-yl)carbonylamino]cyclohexyl]propanoate Openeye Name: tert-butyl 3-[4-[(5-cyanobenzofuran-2-carbonyl)amino]cyclohexyl]propanoate CAS Name: 3-[4-[[(5-cyano-2-benzofuranyl)-oxomethyl]amino]cyclohexyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[(5-cyano-1-benzofuran-2-carbonyl)amino]cyclohexyl]propanoate Traditional Name: 3-[4-[(5-cyanobenzofuran-2-carbonyl)amino]cyclohexyl]propionic acid tert-butyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1CCC(CC1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CCC1CCC(CC1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C#N

InChI

InChI=1S/C23H28N2O4/c1-23(2,3)29-21(26)11-7-15-4-8-18(9-5-15)25-22(27)20-13-17-12-16(14-24)6-10-19(17)28-20/h6,10,12-13,15,18H,4-5,7-9,11H2,1-3H3,(H,25,27)