methyl (2R,3R)-2-[(3-cyanophenyl)methyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: methyl (2R,3R)-2-[(3-cyanophenyl)methyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: methyl (2R,3R)-3-(tert-butoxycarbonylamino)-2-[(3-cyanophenyl)methyl]butanoate CAS Name: (2R,3R)-2-[(3-cyanophenyl)methyl]-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-[(3-cyanophenyl)methyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: (2R,3R)-3-(tert-butoxycarbonylamino)-2-(3-cyanobenzyl)butyric acid methyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC(=C1)C#N)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]([C@@H](CC1=CC=CC(=C1)C#N)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H24N2O4/c1-12(20-17(22)24-18(2,3)4)15(16(21)23-5)10-13-7-6-8-14(9-13)11-19/h6-9,12,15H,10H2,1-5H3,(H,20,22)/t12-,15-/m1/s1