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

Systemtic Name: N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(3-methylphenyl)ethanediamide Openeye Name: N-[(2S)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(m-tolyl)oxamide CAS Name: N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-pyrrolidin-1-iumyl)ethyl]-N'-(3-methylphenyl)oxamide IUPAC Name: N-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-ylethyl]-N'-(3-methylphenyl)oxamide Traditional Name: N-[(2S)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(m-tolyl)oxamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=O)NCC(C2=CC3=C(C=C2)N(CC3)C)[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(=O)NC[C@H](C2=CC3=C(C=C2)N(CC3)C)[NH+]4CCCC4

InChI

InChI=1S/C24H30N4O2/c1-17-6-5-7-20(14-17)26-24(30)23(29)25-16-22(28-11-3-4-12-28)18-8-9-21-19(15-18)10-13-27(21)2/h5-9,14-15,22H,3-4,10-13,16H2,1-2H3,(H,25,29)(H,26,30)/p+1/t22-/m1/s1