methyl 3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]-4-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]-4-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-4-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-4-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-4-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-4-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C24H29N4O4+ MolecularWeight: 437.51146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC

InChI

InChI=1S/C24H28N4O4/c1-16-7-6-8-17-21(16)22(23(25-17)24(30)32-3)26-20(29)15-27-11-13-28(14-12-27)18-9-4-5-10-19(18)31-2/h4-10,25H,11-15H2,1-3H3,(H,26,29)/p+1