methyl (4S)-5-(octylcarbamoyloxy)-4-(2-oxidanylidenedodecanoylamino)pentanoate

Systemtic Name: methyl (4S)-5-(octylcarbamoyloxy)-4-(2-oxidanylidenedodecanoylamino)pentanoate Openeye Name: methyl (4S)-5-(octylcarbamoyloxy)-4-(2-oxododecanoylamino)pentanoate CAS Name: (4S)-4-(1,2-dioxododecylamino)-5-[(octylamino)-oxomethoxy]pentanoic acid methyl ester IUPAC Name: methyl (4S)-5-(octylcarbamoyloxy)-4-(2-oxododecanoylamino)pentanoate Traditional Name: (4S)-4-(2-ketododecanoylamino)-5-(octylcarbamoyloxy)valeric acid methyl ester Formula: C27H50N2O6 MolecularWeight: 498.6957

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)C(=O)NC(CCC(=O)OC)COC(=O)NCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC(=O)C(=O)N[C@@H](CCC(=O)OC)COC(=O)NCCCCCCCC

InChI

InChI=1S/C27H50N2O6/c1-4-6-8-10-12-13-14-16-18-24(30)26(32)29-23(19-20-25(31)34-3)22-35-27(33)28-21-17-15-11-9-7-5-2/h23H,4-22H2,1-3H3,(H,28,33)(H,29,32)/t23-/m0/s1