methyl 4-[[6-(hexanoylamino)indazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[6-(hexanoylamino)indazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[6-(hexanoylamino)indazol-1-yl]methyl]benzoate CAS Name: 4-[[6-(1-oxohexylamino)-1-indazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-(hexanoylamino)indazol-1-yl]methyl]benzoate Traditional Name: 4-[[6-(caproylamino)indazol-1-yl]methyl]benzoic acid methyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC2=C(C=C1)C=NN2CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCC(=O)NC1=CC2=C(C=C1)C=NN2CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H25N3O3/c1-3-4-5-6-21(26)24-19-12-11-18-14-23-25(20(18)13-19)15-16-7-9-17(10-8-16)22(27)28-2/h7-14H,3-6,15H2,1-2H3,(H,24,26)