methyl 3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-(2-fluorophenyl)-1-piperazinyl]-1-oxopropyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(2-fluorophenyl)piperazino]propanoylamino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C24H27FN4O4 MolecularWeight: 454.493983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C24H27FN4O4/c1-32-16-7-8-17-19(15-16)26-23(24(31)33-2)22(17)27-21(30)9-10-28-11-13-29(14-12-28)20-6-4-3-5-18(20)25/h3-8,15,26H,9-14H2,1-2H3,(H,27,30)