[1-[3-(dodecanoylamino)phenyl]-2-methoxy-1,3-bis(oxidanylidene)-3-phenylazanyl-propan-2-yl] octanoate

Systemtic Name: [1-[3-(dodecanoylamino)phenyl]-2-methoxy-1,3-bis(oxidanylidene)-3-phenylazanyl-propan-2-yl] octanoate Openeye Name: [2-anilino-1-[3-(dodecanoylamino)benzoyl]-1-methoxy-2-oxo-ethyl] octanoate CAS Name: octanoic acid [1-anilino-2-methoxy-1,3-dioxo-3-[3-(1-oxododecylamino)phenyl]propan-2-yl] ester IUPAC Name: [1-anilino-3-[3-(dodecanoylamino)phenyl]-2-methoxy-1,3-dioxopropan-2-yl] octanoate Traditional Name: caprylic acid [2-anilino-2-keto-1-[3-(lauroylamino)benzoyl]-1-methoxy-ethyl] ester Formula: C36H52N2O6 MolecularWeight: 608.80788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=CC(=C1)C(=O)C(C(=O)NC2=CC=CC=C2)(OC)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=CC(=C1)C(=O)C(C(=O)NC2=CC=CC=C2)(OC)OC(=O)CCCCCCC

InChI

InChI=1S/C36H52N2O6/c1-4-6-8-10-11-12-13-15-19-26-32(39)37-31-25-21-22-29(28-31)34(41)36(43-3,35(42)38-30-23-17-16-18-24-30)44-33(40)27-20-14-9-7-5-2/h16-18,21-25,28H,4-15,19-20,26-27H2,1-3H3,(H,37,39)(H,38,42)