(phenylmethyl) 4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: (phenylmethyl) 4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: benzyl 3-(tert-butoxycarbonylamino)-4-methyl-benzoate CAS Name: 4-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 3-(tert-butoxycarbonylamino)-4-methyl-benzoic acid benzyl ester Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H23NO4/c1-14-10-11-16(12-17(14)21-19(23)25-20(2,3)4)18(22)24-13-15-8-6-5-7-9-15/h5-12H,13H2,1-4H3,(H,21,23)