heptadecyl (2S)-5-azanyl-2-[[(2R)-2-azanylpropanoyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: heptadecyl (2S)-5-azanyl-2-[[(2R)-2-azanylpropanoyl]amino]-5-oxidanylidene-pentanoate Openeye Name: heptadecyl (2S)-5-amino-2-[[(2R)-2-aminopropanoyl]amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[(2R)-2-amino-1-oxopropyl]amino]-5-oxopentanoic acid heptadecyl ester IUPAC Name: heptadecyl (2S)-5-amino-2-[[(2R)-2-aminopropanoyl]amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[[(2R)-2-aminopropanoyl]amino]-5-keto-valeric acid heptadecyl ester Formula: C25H49N3O4 MolecularWeight: 455.67426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)C(CCC(=O)N)NC(=O)C(C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H](C)N

InChI

InChI=1S/C25H49N3O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-32-25(31)22(18-19-23(27)29)28-24(30)21(2)26/h21-22H,3-20,26H2,1-2H3,(H2,27,29)(H,28,30)/t21-,22+/m1/s1