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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5/c1-5-9-16(19(24)26-4)21-18(23)17(12-14(2)3)22-20(25)27-13-15-10-7-6-8-11-15/h6-8,10-11,14,16-17H,5,9,12-13H2,1-4H3,(H,21,23)(H,22,25)/t16?,17-/m0/s1