methyl (2S)-2,6-bis[3-[ethanoyl(phenylmethoxy)amino]propanoylamino]hexanoate

Systemtic Name: methyl (2S)-2,6-bis[3-[ethanoyl(phenylmethoxy)amino]propanoylamino]hexanoate Openeye Name: methyl (2S)-2,6-bis[3-[acetyl(benzyloxy)amino]propanoylamino]hexanoate CAS Name: (2S)-2,6-bis[[3-[acetyl(phenylmethoxy)amino]-1-oxopropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2,6-bis[3-[acetyl(phenylmethoxy)amino]propanoylamino]hexanoate Traditional Name: (2S)-2,6-bis[3-[acetyl(benzoxy)amino]propanoylamino]hexanoic acid methyl ester Formula: C31H42N4O8 MolecularWeight: 598.68718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCC(=O)NCCCCC(C(=O)OC)NC(=O)CCN(C(=O)C)OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N(CCC(=O)NCCCC[C@@H](C(=O)OC)NC(=O)CCN(C(=O)C)OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C31H42N4O8/c1-24(36)34(42-22-26-12-6-4-7-13-26)20-17-29(38)32-19-11-10-16-28(31(40)41-3)33-30(39)18-21-35(25(2)37)43-23-27-14-8-5-9-15-27/h4-9,12-15,28H,10-11,16-23H2,1-3H3,(H,32,38)(H,33,39)/t28-/m0/s1