名称: 5-(5,5-dimethyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-7-yl)-1H-pyrrole-2-carbonitrile
IUPAC: 5-(5,5-dimethyl-2-oxo-1H-4,1-benzoxazepin-7-yl)-1H-pyrrole-2-carbonitrile
SMILES:
CC1(C)OCC(=O)Nc2ccc(-c3ccc(C#N)[nH]3)cc21Canonical SMILES:
CC1(C2=C(C=CC(=C2)C3=CC=C(N3)C#N)NC(=O)CO1)C分子式: C16H15N3O2
分子量: 281.31
InChIKey: KERXRLFGJZSNBC-UHFFFAOYSA-N
InChI:
PubChem CID: 44579751 →InChI=1S/C16H15N3O2/c1-16(2)12-7-10(13-6-4-11(8-17)18-13)3-5-14(12)19-15(20)9-21-16/h3-7,18H,9H2,1-2H3,(H,19,20)同義語
CHEMBL491206SCHEMBL3985849KERXRLFGJZSNBC-UHFFFAOYSA-NBDBM502642515-(5,5-dimethyl-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-7-yl)-1H-pyrrole-2-carbonitrile5-(5,5-dimethyl-2-oxo-1,2,3,5-tetrahydrobenzo[e][1,4]oxazepin-7-yl)-1H-pyrrole-2-carbonitrile
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