N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanediamide

Systemtic Name: N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanediamide Openeye Name: N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]oxamide CAS Name: N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-piperidin-1-iumyl)ethyl]oxamide IUPAC Name: N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-ylethyl]oxamide Traditional Name: N'-(2-methoxyphenyl)-N-[(2S)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]oxamide Formula: C25H33N4O3+ MolecularWeight: 437.55452

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)C(CNC(=O)C(=O)NC3=CC=CC=C3OC)[NH+]4CCCCC4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)[C@@H](CNC(=O)C(=O)NC3=CC=CC=C3OC)[NH+]4CCCCC4

InChI

InChI=1S/C25H32N4O3/c1-28-15-12-19-16-18(10-11-21(19)28)22(29-13-6-3-7-14-29)17-26-24(30)25(31)27-20-8-4-5-9-23(20)32-2/h4-5,8-11,16,22H,3,6-7,12-15,17H2,1-2H3,(H,26,30)(H,27,31)/p+1/t22-/m1/s1