methyl 5-oxidanylidene-5-(1-phenylmethoxyhexadecan-2-ylamino)pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-(1-phenylmethoxyhexadecan-2-ylamino)pentanoate Openeye Name: methyl 5-[1-(benzyloxymethyl)pentadecylamino]-5-oxo-pentanoate CAS Name: 5-oxo-5-(1-phenylmethoxyhexadecan-2-ylamino)pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-(1-phenylmethoxyhexadecan-2-ylamino)pentanoate Traditional Name: 5-[1-(benzoxymethyl)pentadecylamino]-5-keto-valeric acid methyl ester Formula: C29H49NO4 MolecularWeight: 475.70366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(COCC1=CC=CC=C1)NC(=O)CCCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCC(COCC1=CC=CC=C1)NC(=O)CCCC(=O)OC

InChI

InChI=1S/C29H49NO4/c1-3-4-5-6-7-8-9-10-11-12-13-17-21-27(25-34-24-26-19-15-14-16-20-26)30-28(31)22-18-23-29(32)33-2/h14-16,19-20,27H,3-13,17-18,21-25H2,1-2H3,(H,30,31)