(3S)-4-(2,4-dichlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (3S)-4-(2,4-dichlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (3S)-3-(tert-butoxycarbonylamino)-4-(2,4-dichlorophenyl)butanoate CAS Name: (3S)-4-(2,4-dichlorophenyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoate IUPAC Name: (3S)-4-(2,4-dichlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: (3S)-3-(tert-butoxycarbonylamino)-4-(2,4-dichlorophenyl)butyrate Formula: C15H18Cl2NO4- MolecularWeight: 347.21372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(C=C(C=C1)Cl)Cl)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=C(C=C(C=C1)Cl)Cl)CC(=O)[O-]

InChI

InChI=1S/C15H19Cl2NO4/c1-15(2,3)22-14(21)18-11(8-13(19)20)6-9-4-5-10(16)7-12(9)17/h4-5,7,11H,6,8H2,1-3H3,(H,18,21)(H,19,20)/p-1/t11-/m0/s1