hexadecyl (2S)-2-(methoxycarbonylamino)-3-methyl-pentanoate

Systemtic Name: hexadecyl (2S)-2-(methoxycarbonylamino)-3-methyl-pentanoate Openeye Name: hexadecyl (2S)-2-(methoxycarbonylamino)-3-methyl-pentanoate CAS Name: (2S)-2-(methoxycarbonylamino)-3-methylpentanoic acid hexadecyl ester IUPAC Name: hexadecyl (2S)-2-(methoxycarbonylamino)-3-methylpentanoate Traditional Name: (2S)-2-(carbomethoxyamino)-3-methyl-valeric acid cetyl ester Formula: C24H47NO4 MolecularWeight: 413.63428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(C(C)CC)NC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)[C@H](C(C)CC)NC(=O)OC

InChI

InChI=1S/C24H47NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29-23(26)22(21(3)6-2)25-24(27)28-4/h21-22H,5-20H2,1-4H3,(H,25,27)/t21?,22-/m0/s1