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

Systemtic Name: methyl 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propanoylamino]-5-fluoranyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propanoylamino]-5-fluoro-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxopropyl]amino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propanoylamino]-5-fluoro-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(3-chlorophenyl)piperazino]propanoylamino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester Formula: C23H24ClFN4O3 MolecularWeight: 458.913063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H24ClFN4O3/c1-32-23(31)22-21(18-14-16(25)5-6-19(18)26-22)27-20(30)7-8-28-9-11-29(12-10-28)17-4-2-3-15(24)13-17/h2-6,13-14,26H,7-12H2,1H3,(H,27,30)