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名称: N-[trans-1-benzyl-7-chloro-5-(2-chlorophenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-ylmethyl]glycine

IUPAC: 2-[[(3R,5S)-1-benzyl-7-chloro-5-(2-chlorophenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]methylamino]acetic acid

SMILES: O=C(O)CNC[C@H]1O[C@H](c2ccccc2Cl)c2cc(Cl)ccc2N(Cc2ccccc2)C1=O

Canonical SMILES: C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)C(OC(C2=O)CNCC(=O)O)C4=CC=CC=C4Cl

分子式: C25H22Cl2N2O4

分子量: 485.40

InChIKey: QWAQZAFSNGFZOX-ISKFKSNPSA-N

InChI: InChI=1S/C25H22Cl2N2O4/c26-17-10-11-21-19(12-17)24(18-8-4-5-9-20(18)27)33-22(13-28-14-23(30)31)25(32)29(21)15-16-6-2-1-3-7-16/h1-12,22,24,28H,13-15H2,(H,30,31)/t22-,24-/m1/s1

PubChem CID: 69947765 →

同義語

SCHEMBL6963816QWAQZAFSNGFZOX-ISKFKSNPSA-NN-[trans-1-benzyl-7-chloro-5-(2-chlorophenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-ylmethyl]glycine

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