[2-[4-(hexanoylamino)phenyl]-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-[4-(hexanoylamino)phenyl]-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-[4-(hexanoylamino)phenyl]-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-oxo-2-[4-(1-oxohexylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(hexanoylamino)phenyl]-2-oxoethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-[4-(caproylamino)phenyl]-2-keto-ethyl] ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=NNC3=CC=CC=C32

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=NNC3=CC=CC=C32

InChI

InChI=1S/C22H23N3O4/c1-2-3-4-9-20(27)23-16-12-10-15(11-13-16)19(26)14-29-22(28)21-17-7-5-6-8-18(17)24-25-21/h5-8,10-13H,2-4,9,14H2,1H3,(H,23,27)(H,24,25)