O5-tert-butyl O1-(4-methoxyphenyl)sulfonyl 1,2-diazepine-1,5-dicarboxylate

Systemtic Name: O5-tert-butyl O1-(4-methoxyphenyl)sulfonyl 1,2-diazepine-1,5-dicarboxylate Openeye Name: O5-tert-butyl O1-(4-methoxyphenyl)sulfonyl diazepine-1,5-dicarboxylate CAS Name: diazepine-1,5-dicarboxylic acid O5-tert-butyl ester O1-(4-methoxyphenyl)sulfonyl ester IUPAC Name: 5-O-tert-butyl 1-O-(4-methoxyphenyl)sulfonyl diazepine-1,5-dicarboxylate Traditional Name: diazepine-1,5-dicarboxylic acid O5-tert-butyl ester O1-(4-methoxyphenyl)sulfonyl ester Formula: C18H20N2O7S MolecularWeight: 408.4256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=NN(C=C1)C(=O)OS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=NN(C=C1)C(=O)OS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H20N2O7S/c1-18(2,3)26-16(21)13-9-11-19-20(12-10-13)17(22)27-28(23,24)15-7-5-14(25-4)6-8-15/h5-12H,1-4H3