tert-butyl 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-1,2-diazepine-1-carboxylate

Systemtic Name: tert-butyl 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-1,2-diazepine-1-carboxylate Openeye Name: tert-butyl 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-diazepine-1-carboxylate CAS Name: 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-diazepine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-diazepine-1-carboxylate Traditional Name: 2,5-bis[(4-methoxyphenyl)sulfonyl]-3H-diazepine-1-carboxylic acid tert-butyl ester Formula: C24H28N2O8S2 MolecularWeight: 536.61772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC(=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)N1C=CC(=CCN1S(=O)(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H28N2O8S2/c1-24(2,3)34-23(27)25-16-14-21(35(28,29)20-10-6-18(32-4)7-11-20)15-17-26(25)36(30,31)22-12-8-19(33-5)9-13-22/h6-16H,17H2,1-5H3