methyl (2S)-2-(phenylmethoxycarbonylamino)-6-(tetradecanoylamino)hexanoate

Systemtic Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-6-(tetradecanoylamino)hexanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-6-(tetradecanoylamino)hexanoate CAS Name: (2S)-6-(1-oxotetradecylamino)-2-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-6-(tetradecanoylamino)hexanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-6-(tetradecanoylamino)hexanoic acid methyl ester Formula: C29H48N2O5 MolecularWeight: 504.70182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NCCCCC(C(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C29H48N2O5/c1-3-4-5-6-7-8-9-10-11-12-16-22-27(32)30-23-18-17-21-26(28(33)35-2)31-29(34)36-24-25-19-14-13-15-20-25/h13-15,19-20,26H,3-12,16-18,21-24H2,1-2H3,(H,30,32)(H,31,34)/t26-/m0/s1