[2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] 1H-indazole-3-carboxylate Openeye Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-keto-ethyl] ester Formula: C21H21Cl2N3O3 MolecularWeight: 434.31574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC(=O)COC(=O)C1=NNC2=CC=CC=C21)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC(CNC(=O)COC(=O)C1=NNC2=CC=CC=C21)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O3/c1-2-5-13(15-9-8-14(22)10-17(15)23)11-24-19(27)12-29-21(28)20-16-6-3-4-7-18(16)25-26-20/h3-4,6-10,13H,2,5,11-12H2,1H3,(H,24,27)(H,25,26)