(phenylmethyl) 3-methyl-2-(pentanoylamino)butanoate

Systemtic Name: (phenylmethyl) 3-methyl-2-(pentanoylamino)butanoate Openeye Name: benzyl 3-methyl-2-(pentanoylamino)butanoate CAS Name: 3-methyl-2-(1-oxopentylamino)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-(pentanoylamino)butanoate Traditional Name: 3-methyl-2-(valerylamino)butyric acid benzyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(C(C)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC(=O)NC(C(C)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H25NO3/c1-4-5-11-15(19)18-16(13(2)3)17(20)21-12-14-9-7-6-8-10-14/h6-10,13,16H,4-5,11-12H2,1-3H3,(H,18,19)