(2S)-2,5-bis(azanyl)-N,N-bis(1-oxidanyl-3-oxidanylidene-hexadecan-2-yl)pentanamide

Systemtic Name: (2S)-2,5-bis(azanyl)-N,N-bis(1-oxidanyl-3-oxidanylidene-hexadecan-2-yl)pentanamide Openeye Name: (2S)-2,5-diamino-N,N-bis[1-(hydroxymethyl)-2-oxo-pentadecyl]pentanamide CAS Name: (2S)-2,5-diamino-N,N-bis(1-hydroxy-3-oxohexadecan-2-yl)pentanamide IUPAC Name: (2S)-2,5-diamino-N,N-bis(1-hydroxy-3-oxohexadecan-2-yl)pentanamide Traditional Name: (2S)-2,5-diamino-N,N-bis(2-keto-1-methylol-pentadecyl)valeramide Formula: C37H73N3O5 MolecularWeight: 639.99262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C(CO)N(C(CO)C(=O)CCCCCCCCCCCCC)C(=O)C(CCCN)N

Isomeric SMILES

CCCCCCCCCCCCCC(=O)C(CO)N(C(CO)C(=O)CCCCCCCCCCCCC)C(=O)[C@H](CCCN)N

InChI

InChI=1S/C37H73N3O5/c1-3-5-7-9-11-13-15-17-19-21-23-27-35(43)33(30-41)40(37(45)32(39)26-25-29-38)34(31-42)36(44)28-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,41-42H,3-31,38-39H2,1-2H3/t32-,33?,34?/m0/s1