phenacyl 3-[phenacyl-[phenacyl-(3-phenacyloxycarbonylphenyl)amino]amino]benzoate

Systemtic Name: phenacyl 3-[phenacyl-[phenacyl-(3-phenacyloxycarbonylphenyl)amino]amino]benzoate Openeye Name: phenacyl 3-[phenacyl-(N-phenacyl-3-phenacyloxycarbonyl-anilino)amino]benzoate CAS Name: 3-[[3-[oxo(phenacyloxy)methyl]-N-phenacylanilino]-phenacylamino]benzoic acid phenacyl ester IUPAC Name: phenacyl 3-[phenacyl-(N-phenacyl-3-phenacyloxycarbonylanilino)amino]benzoate Traditional Name: 3-[phenacyl-(N-phenacyl-3-phenacyloxycarbonyl-anilino)amino]benzoic acid phenacyl ester Formula: C46H36N2O8 MolecularWeight: 744.78664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CN(C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=CC=C3)N(CC(=O)C4=CC=CC=C4)C5=CC=CC(=C5)C(=O)OCC(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CN(C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=CC=C3)N(CC(=O)C4=CC=CC=C4)C5=CC=CC(=C5)C(=O)OCC(=O)C6=CC=CC=C6

InChI

InChI=1S/C46H36N2O8/c49-41(33-15-5-1-6-16-33)29-47(39-25-13-23-37(27-39)45(53)55-31-43(51)35-19-9-3-10-20-35)48(30-42(50)34-17-7-2-8-18-34)40-26-14-24-38(28-40)46(54)56-32-44(52)36-21-11-4-12-22-36/h1-28H,29-32H2