(phenylmethyl) 2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate Openeye Name: benzyl 2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]acetate CAS Name: 2-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]acetic acid benzyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O5/c1-16(2)20(24-22(27)29-15-18-11-7-4-8-12-18)21(26)23-13-19(25)28-14-17-9-5-3-6-10-17/h3-12,16,20H,13-15H2,1-2H3,(H,23,26)(H,24,27)/t20-/m0/s1