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CAS Number: 1259297-98-7
2-tert-butyl 7-methyl 4,5-dihydro-1H-benzo[c]azepine-2,7(3H)-dicarboxylate

Structure

 2-tert-butyl 7-methyl 4,5-dihydro-1H-benzo[c]azepine-2,7(3H)-dicarboxylate
Name: 2-tert-butyl 7-methyl 4,5-dihydro-1H-benzo[c]azepine-2,7(3H)-dicarboxylate
Synonyms:
General Information
Product Number: 1259297987

CAS Registry Number 1259297-98-7
Name:
2H-?2-?Benzazepine-?2,?7-?dicarboxylic acid, 1,?3,?4,?5-?tetrahydro-?, 2-?(1,?1-?dimethylethyl) 7-?methyl ester

 

Chemical Formula: C17H23NO4
Exact Mass: 305.16
Molecular Weight: 305.37
m/z: 305.16 (100.0%), 306.17 (18.8%), 307.17 (2.5%)

 

InChI:InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-9-5-6-12-10-13(15(19)21-4)7-8-14(12)11-18/h7-8,10H,5-6,9,11H2,1-4H3

InChI Key:JHSHXCLDUYTTBT-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCCC2=C(C1)C=CC(=C2)C(=O)OC

Specification

98%
References

PCT Int. Appl. (2010), WO 2010151318 A1 20101229. 

Journal of Medicinal Chemistry (2013), 56(18), 7201-7211.
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