(4-chlorophenyl) 4-[(4,4-dimethyl-3-oxidanylidene-pentan-2-yl)oxycarbonylamino]-2-(phenylmethyl)butanoate

Systemtic Name: (4-chlorophenyl) 4-[(4,4-dimethyl-3-oxidanylidene-pentan-2-yl)oxycarbonylamino]-2-(phenylmethyl)butanoate Openeye Name: (4-chlorophenyl) 2-benzyl-4-[(1,3,3-trimethyl-2-oxo-butoxy)carbonylamino]butanoate CAS Name: 4-[[(4,4-dimethyl-3-oxopentan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethyl)butanoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 2-benzyl-4-[(4,4-dimethyl-3-oxopentan-2-yl)oxycarbonylamino]butanoate Traditional Name: 2-benzyl-4-[(2-keto-1,3,3-trimethyl-butoxy)carbonylamino]butyric acid (4-chlorophenyl) ester Formula: C25H30ClNO5 MolecularWeight: 459.9624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30ClNO5/c1-17(22(28)25(2,3)4)31-24(30)27-15-14-19(16-18-8-6-5-7-9-18)23(29)32-21-12-10-20(26)11-13-21/h5-13,17,19H,14-16H2,1-4H3,(H,27,30)