(phenylmethyl) 5-(octadecylamino)-5-oxidanylidene-4-(2-phenylethanoylamino)pentanoate

Systemtic Name: (phenylmethyl) 5-(octadecylamino)-5-oxidanylidene-4-(2-phenylethanoylamino)pentanoate Openeye Name: benzyl 5-(octadecylamino)-5-oxo-4-[(2-phenylacetyl)amino]pentanoate CAS Name: 5-(octadecylamino)-5-oxo-4-[(1-oxo-2-phenylethyl)amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(octadecylamino)-5-oxo-4-[(2-phenylacetyl)amino]pentanoate Traditional Name: 5-keto-4-[(2-phenylacetyl)amino]-5-(stearylamino)valeric acid benzyl ester Formula: C38H58N2O4 MolecularWeight: 606.87812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C38H58N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-30-39-38(43)35(40-36(41)31-33-24-19-17-20-25-33)28-29-37(42)44-32-34-26-21-18-22-27-34/h17-22,24-27,35H,2-16,23,28-32H2,1H3,(H,39,43)(H,40,41)