(2S)-4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoic acid Openeye Name: (2S)-2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-4-methyl-2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoic acid Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-methyl-valeric acid Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5/c1-13(2)10-16(18(23)21-17(19(24)25)11-14(3)4)22-20(26)27-12-15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-12H2,1-4H3,(H,21,23)(H,22,26)(H,24,25)/t16?,17-/m0/s1