diethyl (2R,3S)-2-(octadecanoylamino)-3-(phenylmethoxymethoxy)butanedioate

Systemtic Name: diethyl (2R,3S)-2-(octadecanoylamino)-3-(phenylmethoxymethoxy)butanedioate Openeye Name: diethyl (2S,3R)-2-(benzyloxymethoxy)-3-(octadecanoylamino)butanedioate CAS Name: (2R,3S)-2-(1-oxooctadecylamino)-3-(phenylmethoxymethoxy)butanedioic acid diethyl ester IUPAC Name: diethyl (2R,3S)-2-(octadecanoylamino)-3-(phenylmethoxymethoxy)butanedioate Traditional Name: (2S,3R)-2-(benzoxymethoxy)-3-stearamido-succinic acid diethyl ester Formula: C34H57NO7 MolecularWeight: 591.81888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(C(C(=O)OCC)OCOCC1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@H]([C@@H](C(=O)OCC)OCOCC1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C34H57NO7/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-30(36)35-31(33(37)40-5-2)32(34(38)41-6-3)42-28-39-27-29-24-21-20-22-25-29/h20-22,24-25,31-32H,4-19,23,26-28H2,1-3H3,(H,35,36)/t31-,32+/m1/s1