methyl (2R)-3-(4-azanyl-2-chloranyl-3,5-dimethyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(4-azanyl-2-chloranyl-3,5-dimethyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2R)-3-(4-amino-2-chloro-3,5-dimethyl-phenyl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2R)-3-(4-amino-2-chloro-3,5-dimethylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(4-amino-2-chloro-3,5-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-3-(4-amino-2-chloro-3,5-dimethyl-phenyl)-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C17H25ClN2O4 MolecularWeight: 356.8444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1N)C)Cl)CC(C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1N)C)Cl)C[C@H](C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H25ClN2O4/c1-9-7-11(13(18)10(2)14(9)19)8-12(15(21)23-6)20-16(22)24-17(3,4)5/h7,12H,8,19H2,1-6H3,(H,20,22)/t12-/m1/s1