methyl 1-[2-oxidanylidene-2-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethoxy]ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethoxy]ethyl]indole-3-carboxylic acid methyl ester Formula: C23H25N4O5+ MolecularWeight: 437.4684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)OCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)OCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C23H24N4O5/c1-31-23(30)18-14-27(19-7-3-2-6-17(18)19)15-22(29)32-16-21(28)26-12-10-25(11-13-26)20-8-4-5-9-24-20/h2-9,14H,10-13,15-16H2,1H3/p+1