methyl 2-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl]amino]benzoate CAS Name: 2-[[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl]amino]benzoate Traditional Name: 2-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]amino]benzoic acid methyl ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C(=NO2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C(=NO2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C20H24N2O4/c1-20(2,3)12-9-10-16-14(11-12)17(22-26-16)18(23)21-15-8-6-5-7-13(15)19(24)25-4/h5-8,12H,9-11H2,1-4H3,(H,21,23)/t12-/m0/s1