(3R)-1-(4-methoxyphenyl)-5-oxidanylidene-N-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methoxyphenyl)-5-oxidanylidene-N-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(4-methoxyphenyl)-5-oxo-N-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]pyrrolidine-3-carboxamide CAS Name: (3R)-1-(4-methoxyphenyl)-5-oxo-N-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(4-methoxyphenyl)-5-oxo-N-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]pyrrolidine-3-carboxamide Traditional Name: (3R)-5-keto-N-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-1-(4-methoxyphenyl)pyrrolidine-3-carboxamide Formula: C23H28N5O4+ MolecularWeight: 438.49952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

COC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)NCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C23H27N5O4/c1-32-19-7-5-18(6-8-19)28-16-17(14-21(28)29)23(31)25-15-22(30)27-12-10-26(11-13-27)20-4-2-3-9-24-20/h2-9,17H,10-16H2,1H3,(H,25,31)/p+1/t17-/m1/s1