N#Cc1cc(Cl)c2nc(-c3cc(Cl)nn3-c3ncccc3Cl)oc(=O)c2c1
이름: cyanobenzoxazinone
IUPAC: 8-chloro-2-[3-chloro-1-(3-chloro-2-pyridinyl)pyrazol-5-yl]-4-oxo-3,1-benzoxazine-6-carbonitrile
SMILES: N#Cc1cc(Cl)c2nc(-c3cc(Cl)nn3-c3ncccc3Cl)oc(=O)c2c1
Canonical SMILES: C1=CC(=C(N=C1)N2C(=CC(=N2)Cl)C3=NC4=C(C=C(C=C4Cl)C#N)C(=O)O3)Cl
분자식: C17H6Cl3N5O2
분자량: 418.60
InChIKey: UEMSNTQDCVISEC-UHFFFAOYSA-N
InChI: InChI=1S/C17H6Cl3N5O2/c18-10-2-1-3-22-15(10)25-12(6-13(20)24-25)16-23-14-9(17(26)27-16)4-8(7-21)5-11(14)19/h1-6H
PubChem CID: 66857562

동의어

SCHEMBL958508UEMSNTQDCVISEC-UHFFFAOYSA-N8-chloro-2-[3-chloro-1-(3-chloro-2-pyridinyl)-1H-pyrazol-5-yl]-6-cyano-4H-3, 1-benzoxazin-4-one8-chloro-2-[3-chloro-1-(3-chloro-2-pyridinyl)-1H-pyrazol-5-yl]-6-cyano-4H-3,1-benzoxazin-4-one