ethyl 3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-5-fluoranyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-5-fluoranyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propanoylamino]-5-fluoro-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-oxopropyl]amino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoylamino]-5-fluoro-1H-indole-2-carboxylate Traditional Name: 3-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]propanoylamino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester Formula: C25H28ClFN4O3 MolecularWeight: 486.966223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)C(C)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)C(C)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

InChI

InChI=1S/C25H28ClFN4O3/c1-4-34-25(33)23-22(19-14-18(27)7-8-20(19)28-23)29-24(32)16(3)30-9-11-31(12-10-30)21-13-17(26)6-5-15(21)2/h5-8,13-14,16,28H,4,9-12H2,1-3H3,(H,29,32)