CC(C)N1C(=O)[C@@H](CCO)O[C@H](c2ccccc2Cl)c2cc(Cl)ccc21
Nom: trans-7-chloro-5-(2-chlorophenyl)-1-isopropyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine-3-ethanol
IUPAC: (3R,5S)-7-chloro-5-(2-chlorophenyl)-3-(2-hydroxyethyl)-1-propan-2-yl-5H-4,1-benzoxazepin-2-one
SMILES: CC(C)N1C(=O)[C@@H](CCO)O[C@H](c2ccccc2Cl)c2cc(Cl)ccc21
Canonical SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CCO)C3=CC=CC=C3Cl
Formule moléculaire: C20H21Cl2NO3
Masse molaire: 394.30
InChIKey: XVZDSJJVWKTOKJ-RTBURBONSA-N
InChI: InChI=1S/C20H21Cl2NO3/c1-12(2)23-17-8-7-13(21)11-15(17)19(14-5-3-4-6-16(14)22)26-18(9-10-24)20(23)25/h3-8,11-12,18-19,24H,9-10H2,1-2H3/t18-,19-/m1/s1
PubChem CID: 69945311 →

Synonymes

SCHEMBL6951630XVZDSJJVWKTOKJ-RTBURBONSA-Ntrans-7-chloro-5-(2-chlorophenyl)-1-isopropyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine-3-ethanol
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