N'-(2-methoxy-5-methyl-phenyl)-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanediamide

Systemtic Name: N'-(2-methoxy-5-methyl-phenyl)-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanediamide Openeye Name: N'-(2-methoxy-5-methyl-phenyl)-N-[(2R)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]oxamide CAS Name: N'-(2-methoxy-5-methylphenyl)-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-piperidin-1-iumyl)ethyl]oxamide IUPAC Name: N'-(2-methoxy-5-methylphenyl)-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-ylethyl]oxamide Traditional Name: N'-(2-methoxy-5-methyl-phenyl)-N-[(2R)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]oxamide Formula: C26H35N4O3+ MolecularWeight: 451.5811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NCC(C2=CC3=C(C=C2)N(CC3)C)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NC[C@@H](C2=CC3=C(C=C2)N(CC3)C)[NH+]4CCCCC4

InChI

InChI=1S/C26H34N4O3/c1-18-7-10-24(33-3)21(15-18)28-26(32)25(31)27-17-23(30-12-5-4-6-13-30)19-8-9-22-20(16-19)11-14-29(22)2/h7-10,15-16,23H,4-6,11-14,17H2,1-3H3,(H,27,31)(H,28,32)/p+1/t23-/m0/s1