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الاسم: Trans-7-chloro-5-(2-chlorophenyl)-3-(cyanomethylaminocarbonylmethyl)-1-isopropyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine

IUPAC: 2-[(3R,5S)-7-chloro-5-(2-chlorophenyl)-2-oxo-1-propan-2-yl-5H-4,1-benzoxazepin-3-yl]-N-(cyanomethyl)acetamide

SMILES: CC(C)N1C(=O)[C@@H](CC(=O)NCC#N)O[C@H](c2ccccc2Cl)c2cc(Cl)ccc21

Canonical SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CC(=O)NCC#N)C3=CC=CC=C3Cl

الصيغة الجزيئية: C22H21Cl2N3O3

الوزن الجزيئي: 446.30

InChIKey: VNXZYGGCUIXJCW-TZIWHRDSSA-N

InChI: InChI=1S/C22H21Cl2N3O3/c1-13(2)27-18-8-7-14(23)11-16(18)21(15-5-3-4-6-17(15)24)30-19(22(27)29)12-20(28)26-10-9-25/h3-8,11,13,19,21H,10,12H2,1-2H3,(H,26,28)/t19-,21-/m1/s1

PubChem CID: 88069016 →

مرادفات

SCHEMBL6964552VNXZYGGCUIXJCW-TZIWHRDSSA-Ntrans-7-chloro-5-(2-chlorophenyl)-3-(cyanomethylaminocarbonylmethyl)-1-isopropyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine

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