methyl 2-(4-chlorophenyl)-2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(4-chlorophenyl)-2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]ethanoate Openeye Name: methyl 2-(4-chlorophenyl)-2-[4-(1H-indazole-3-carbonyl)piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[1H-indazol-3-yl(oxo)methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-2-[4-(1H-indazole-3-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-(1H-indazole-3-carbonyl)piperazino]acetic acid methyl ester Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H21ClN4O3/c1-29-21(28)19(14-6-8-15(22)9-7-14)25-10-12-26(13-11-25)20(27)18-16-4-2-3-5-17(16)23-24-18/h2-9,19H,10-13H2,1H3,(H,23,24)