(phenylmethyl) 4-acetamido-5-(dodecylamino)-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4-acetamido-5-(dodecylamino)-5-oxidanylidene-pentanoate Openeye Name: benzyl 4-acetamido-5-(dodecylamino)-5-oxo-pentanoate CAS Name: 4-acetamido-5-(dodecylamino)-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-acetamido-5-(dodecylamino)-5-oxopentanoate Traditional Name: 4-acetamido-5-keto-5-(laurylamino)valeric acid benzyl ester Formula: C26H42N2O4 MolecularWeight: 446.62268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C26H42N2O4/c1-3-4-5-6-7-8-9-10-11-15-20-27-26(31)24(28-22(2)29)18-19-25(30)32-21-23-16-13-12-14-17-23/h12-14,16-17,24H,3-11,15,18-21H2,1-2H3,(H,27,31)(H,28,29)