2-[[(2S)-4-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]pentanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S)-4-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]pentanoyl]amino]ethanoate Openeye Name: 2-[[(2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-methyl-pentanoyl]amino]acetate CAS Name: 2-[[(2S)-4-methyl-1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]pentyl]amino]acetate IUPAC Name: 2-[[(2S)-4-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]pentanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-methyl-pentanoyl]amino]acetate Formula: C18H24N3O6- MolecularWeight: 378.39966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)[O-])NC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O6/c1-12(2)8-14(17(25)19-10-16(23)24)21-15(22)9-20-18(26)27-11-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H,19,25)(H,20,26)(H,21,22)(H,23,24)/p-1/t14-/m0/s1