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

Systemtic Name: methyl (2S)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate Openeye Name: methyl (2S)-2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]pentanoate CAS Name: (2S)-2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoate Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]valeric acid methyl ester Formula: C20H30N2O5 MolecularWeight: 378.4626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5/c1-5-10-16(19(24)26-4)21-18(23)17(14(3)6-2)22-20(25)27-13-15-11-8-7-9-12-15/h7-9,11-12,14,16-17H,5-6,10,13H2,1-4H3,(H,21,23)(H,22,25)/t14?,16-,17?/m0/s1