methyl 3-[2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(9H-fluoren-9-yl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C30H31N4O3+ MolecularWeight: 495.59214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CCN(CC3)C4C5=CC=CC=C5C6=CC=CC=C46)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CCN(CC3)C4C5=CC=CC=C5C6=CC=CC=C46)C(=O)OC

InChI

InChI=1S/C30H30N4O3/c1-19-11-12-25-24(17-19)27(28(31-25)30(36)37-2)32-26(35)18-33-13-15-34(16-14-33)29-22-9-5-3-7-20(22)21-8-4-6-10-23(21)29/h3-12,17,29,31H,13-16,18H2,1-2H3,(H,32,35)/p+1