[4-oxidanylidene-4-(3-oxidanylidenepropylamino)-3-(phenylmethoxycarbonylamino)butan-2-yl] tetradecanoate

Systemtic Name: [4-oxidanylidene-4-(3-oxidanylidenepropylamino)-3-(phenylmethoxycarbonylamino)butan-2-yl] tetradecanoate Openeye Name: [2-(benzyloxycarbonylamino)-1-methyl-3-oxo-3-(3-oxopropylamino)propyl] tetradecanoate CAS Name: tetradecanoic acid [4-oxo-4-(3-oxopropylamino)-3-(phenylmethoxycarbonylamino)butan-2-yl] ester IUPAC Name: [4-oxo-4-(3-oxopropylamino)-3-(phenylmethoxycarbonylamino)butan-2-yl] tetradecanoate Traditional Name: myristic acid [2-(benzyloxycarbonylamino)-3-keto-3-(3-ketopropylamino)-1-methyl-propyl] ester Formula: C29H46N2O6 MolecularWeight: 518.68534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H46N2O6/c1-3-4-5-6-7-8-9-10-11-12-16-20-26(33)37-24(2)27(28(34)30-21-17-22-32)31-29(35)36-23-25-18-14-13-15-19-25/h13-15,18-19,22,24,27H,3-12,16-17,20-21,23H2,1-2H3,(H,30,34)(H,31,35)