ethyl 3-[3-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]propanoylamino]-5-methoxy-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]propanoylamino]-5-methoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]propanoylamino]-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-oxopropyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]propanoylamino]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(2-furoyl)piperazin-1-ium-1-yl]propanoylamino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C24H29N4O6+ MolecularWeight: 469.51026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CC[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CC[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H28N4O6/c1-3-33-24(31)22-21(17-15-16(32-2)6-7-18(17)25-22)26-20(29)8-9-27-10-12-28(13-11-27)23(30)19-5-4-14-34-19/h4-7,14-15,25H,3,8-13H2,1-2H3,(H,26,29)/p+1