(2,4-dichlorophenyl)methyl 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (2,4-dichlorophenyl)methyl 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (2,4-dichlorophenyl)methyl 2-(benzyloxycarbonylamino)-3-methyl-pentanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-valeric acid (2,4-dichlorobenzyl) ester Formula: C21H23Cl2NO4 MolecularWeight: 424.31762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=C(C=C(C=C1)Cl)Cl)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OCC1=C(C=C(C=C1)Cl)Cl)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23Cl2NO4/c1-3-14(2)19(24-21(26)28-12-15-7-5-4-6-8-15)20(25)27-13-16-9-10-17(22)11-18(16)23/h4-11,14,19H,3,12-13H2,1-2H3,(H,24,26)