1-[(3R)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[(3R)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-[(3R)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C24H35N4O4+ MolecularWeight: 443.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC(CC3)(C(=O)N)[NH+]4CCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)N3CCC(CC3)(C(=O)N)[NH+]4CCCCC4

InChI

InChI=1S/C24H34N4O4/c1-2-16-32-19-8-6-18(7-9-19)28-21(29)17-20(22(28)30)26-14-10-24(11-15-26,23(25)31)27-12-4-3-5-13-27/h6-9,20H,2-5,10-17H2,1H3,(H2,25,31)/p+1/t20-/m1/s1