(phenylmethyl) 3-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]oxytetradecanoate

Systemtic Name: (phenylmethyl) 3-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]oxytetradecanoate Openeye Name: benzyl 3-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxytetradecanoate CAS Name: 3-[(2S,3S)-2-amino-3-methyl-1-oxopentoxy]tetradecanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2S,3S)-2-amino-3-methylpentanoyl]oxytetradecanoate Traditional Name: 3-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxymyristic acid benzyl ester Formula: C27H45NO4 MolecularWeight: 447.6505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)OCC1=CC=CC=C1)OC(=O)C(C(C)CC)N

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)OCC1=CC=CC=C1)OC(=O)[C@H]([C@@H](C)CC)N

InChI

InChI=1S/C27H45NO4/c1-4-6-7-8-9-10-11-12-16-19-24(32-27(30)26(28)22(3)5-2)20-25(29)31-21-23-17-14-13-15-18-23/h13-15,17-18,22,24,26H,4-12,16,19-21,28H2,1-3H3/t22-,24?,26-/m0/s1