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methyl 3-[5-cyano-1-(oxan-2-yl)indazol-3-yl]benzoate

methyl 3-[5-cyano-1-(oxan-2-yl)indazol-3-yl]benzoate

Systemtic Name:methyl 3-[5-cyano-1-(oxan-2-yl)indazol-3-yl]benzoate
Openeye Name:methyl 3-(5-cyano-1-tetrahydropyran-2-yl-indazol-3-yl)benzoate
CAS Name:3-[5-cyano-1-(2-oxanyl)-3-indazolyl]benzoic acid methyl ester
IUPAC Name:methyl 3-[5-cyano-1-(oxan-2-yl)indazol-3-yl]benzoate
Traditional Name:3-(5-cyano-1-tetrahydropyran-2-yl-indazol-3-yl)benzoic acid methyl ester
Formula: C21H19N3O3
MolecularWeight: 361.39386
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=NN(C3=C2C=C(C=C3)C#N)C4CCCCO4


Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=NN(C3=C2C=C(C=C3)C#N)C4CCCCO4


InChI

InChI=1S/C21H19N3O3/c1-26-21(25)16-6-4-5-15(12-16)20-17-11-14(13-22)8-9-18(17)24(23-20)19-7-2-3-10-27-19/h4-6,8-9,11-12,19H,2-3,7,10H2,1H3


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