[2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]methyl 4-nitrobenzenesulfonate

Systemtic Name: [2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]methyl 4-nitrobenzenesulfonate Openeye Name: [2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]methyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl]methyl ester IUPAC Name: [2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]methyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-3-yl]methyl ester Formula: C38H37N3O11S MolecularWeight: 743.77888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)COS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)COS(=O)(=O)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C38H37N3O11S/c1-25-22-40(37(43)39-36(25)42)35-21-26(23-51-53(46,47)33-19-13-30(14-20-33)41(44)45)34(52-35)24-50-38(27-7-5-4-6-8-27,28-9-15-31(48-2)16-10-28)29-11-17-32(49-3)18-12-29/h4-20,22,26,34-35H,21,23-24H2,1-3H3,(H,39,42,43)