O6-[1-(methylamino)-1-oxidanylidene-hexadecan-3-yl] O1-(phenylmethyl) 2-[(4-methoxyphenyl)carbonylamino]hexanedioate

Systemtic Name: O6-[1-(methylamino)-1-oxidanylidene-hexadecan-3-yl] O1-(phenylmethyl) 2-[(4-methoxyphenyl)carbonylamino]hexanedioate Openeye Name: O1-benzyl O6-[1-[2-(methylamino)-2-oxo-ethyl]tetradecyl] 2-[(4-methoxybenzoyl)amino]hexanedioate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]hexanedioic acid O6-[1-(methylamino)-1-oxohexadecan-3-yl] ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 6-O-[1-(methylamino)-1-oxohexadecan-3-yl] 2-[(4-methoxybenzoyl)amino]hexanedioate Traditional Name: 2-(p-anisoylamino)adipic acid O1-benzyl ester O6-[1-[2-keto-2-(methylamino)ethyl]tetradecyl] ester Formula: C38H56N2O7 MolecularWeight: 652.86044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)NC)OC(=O)CCCC(C(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)NC)OC(=O)CCCC(C(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C38H56N2O7/c1-4-5-6-7-8-9-10-11-12-13-17-21-33(28-35(41)39-2)47-36(42)23-18-22-34(38(44)46-29-30-19-15-14-16-20-30)40-37(43)31-24-26-32(45-3)27-25-31/h14-16,19-20,24-27,33-34H,4-13,17-18,21-23,28-29H2,1-3H3,(H,39,41)(H,40,43)