2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]ethanoic acid Openeye Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]acetic acid CAS Name: 2-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]acetic acid IUPAC Name: 2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]acetic acid Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]acetic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5/c1-3-11(2)14(15(21)17-9-13(19)20)18-16(22)23-10-12-7-5-4-6-8-12/h4-8,11,14H,3,9-10H2,1-2H3,(H,17,21)(H,18,22)(H,19,20)/t11?,14-/m0/s1