methyl 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoyl]amino]-1H-indole-2-carboxylate

Systemtic Name: methyl 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoyl]amino]-1H-indole-2-carboxylate Openeye Name: methyl 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoyl]amino]-1H-indole-2-carboxylate CAS Name: 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxopropyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoyl]amino]-1H-indole-2-carboxylate Traditional Name: 4-methoxy-3-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoyl]amino]-1H-indole-2-carboxylic acid methyl ester Formula: C25H31N4O5+ MolecularWeight: 467.53744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(NC2=C1C(=CC=C2)OC)C(=O)OC)[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

C[C@H](C(=O)NC1=C(NC2=C1C(=CC=C2)OC)C(=O)OC)[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H30N4O5/c1-16(28-12-14-29(15-13-28)18-9-5-6-10-19(18)32-2)24(30)27-22-21-17(8-7-11-20(21)33-3)26-23(22)25(31)34-4/h5-11,16,26H,12-15H2,1-4H3,(H,27,30)/p+1/t16-/m1/s1