[5-(2-oxidanylidene-1,3-diazocan-1-yl)-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(2-oxidanylidene-1,3-diazocan-1-yl)-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate Openeye Name: [3,4-dibenzoyloxy-5-(2-oxo-1,3-diazocan-1-yl)tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4-dibenzoyloxy-5-(2-oxo-1,3-diazocan-1-yl)-2-oxolanyl]methyl ester IUPAC Name: [3,4-dibenzoyloxy-5-(2-oxo-1,3-diazocan-1-yl)oxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [3,4-dibenzoyloxy-5-(2-keto-1,3-diazocan-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C32H32N2O8 MolecularWeight: 572.60508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)N(CC1)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCNC(=O)N(CC1)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H32N2O8/c35-29(22-13-5-1-6-14-22)39-21-25-26(41-30(36)23-15-7-2-8-16-23)27(42-31(37)24-17-9-3-10-18-24)28(40-25)34-20-12-4-11-19-33-32(34)38/h1-3,5-10,13-18,25-28H,4,11-12,19-21H2,(H,33,38)