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الاسم: 3-(4-chloro-phenyl)-4,5,7,8-tetrahydro-1H-1,2,6-triaza-azulene-6-carboxylic acid tert-butyl ester

IUPAC: tert-butyl 3-(4-chlorophenyl)-4,5,7,8-tetrahydro-1H-pyrazolo[4,5-d]azepine-6-carboxylate

SMILES: CC(C)(C)OC(=O)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2CC1

Canonical SMILES: CC(C)(C)OC(=O)N1CCC2=C(CC1)NN=C2C3=CC=C(C=C3)Cl

الصيغة الجزيئية: C18H22ClN3O2

الوزن الجزيئي: 347.80

InChIKey: RKGYNXZCUQESOH-UHFFFAOYSA-N

InChI: InChI=1S/C18H22ClN3O2/c1-18(2,3)24-17(23)22-10-8-14-15(9-11-22)20-21-16(14)12-4-6-13(19)7-5-12/h4-7H,8-11H2,1-3H3,(H,20,21)

PubChem CID: 67269020 →

مرادفات

SCHEMBL2074437RKGYNXZCUQESOH-UHFFFAOYSA-N3-(4-chloro-phenyl)-4,5,7,8- tetrahydro-1H-1,2,6-triaza-azulene-6-carboxylic acid tert-butyl ester3-(4-chloro-phenyl)-4,5,7,8-tetrahydro-1H-1,2,6-triaza-azulene-6-carboxylic acid tert-butyl ester

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