tert-butyl 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylate

Systemtic Name: tert-butyl 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylate Openeye Name: tert-butyl 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylate CAS Name: 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylate Traditional Name: 1,4-bis[(4-methoxyphenyl)sulfonyl]-1,4-diazepane-5-carboxylic acid tert-butyl ester Formula: C24H32N2O8S2 MolecularWeight: 540.64948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCN(CCN1S(=O)(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1CCN(CCN1S(=O)(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H32N2O8S2/c1-24(2,3)34-23(27)22-14-15-25(35(28,29)20-10-6-18(32-4)7-11-20)16-17-26(22)36(30,31)21-12-8-19(33-5)9-13-21/h6-13,22H,14-17H2,1-5H3