(4-chlorophenyl) 4-[(1-butanoyloxy-2-methyl-propoxy)carbonylamino]-2-(phenylmethyl)butanoate

Systemtic Name: (4-chlorophenyl) 4-[(1-butanoyloxy-2-methyl-propoxy)carbonylamino]-2-(phenylmethyl)butanoate Openeye Name: (4-chlorophenyl) 2-benzyl-4-[(1-butanoyloxy-2-methyl-propoxy)carbonylamino]butanoate CAS Name: 4-[[[2-methyl-1-(1-oxobutoxy)propoxy]-oxomethyl]amino]-2-(phenylmethyl)butanoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 2-benzyl-4-[(1-butanoyloxy-2-methylpropoxy)carbonylamino]butanoate Traditional Name: 2-benzyl-4-[(1-butyryloxy-2-methyl-propoxy)carbonylamino]butyric acid (4-chlorophenyl) ester Formula: C26H32ClNO6 MolecularWeight: 489.98838

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C(C)C)OC(=O)NCCC(CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC(=O)OC(C(C)C)OC(=O)NCCC(CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C26H32ClNO6/c1-4-8-23(29)33-25(18(2)3)34-26(31)28-16-15-20(17-19-9-6-5-7-10-19)24(30)32-22-13-11-21(27)12-14-22/h5-7,9-14,18,20,25H,4,8,15-17H2,1-3H3,(H,28,31)