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

Systemtic Name: N'-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-propyl-ethanediamide Openeye Name: N'-[(2S)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-propyl-oxamide CAS Name: N'-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-pyrrolidin-1-iumyl)ethyl]-N-propyloxamide IUPAC Name: N'-[(2S)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-ylethyl]-N-propyloxamide Traditional Name: N'-[(2S)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-propyl-oxamide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(=O)NCC(C1=CC2=C(C=C1)N(CC2)C)[NH+]3CCCC3

Isomeric SMILES

CCCNC(=O)C(=O)NC[C@H](C1=CC2=C(C=C1)N(CC2)C)[NH+]3CCCC3

InChI

InChI=1S/C20H30N4O2/c1-3-9-21-19(25)20(26)22-14-18(24-10-4-5-11-24)15-6-7-17-16(13-15)8-12-23(17)2/h6-7,13,18H,3-5,8-12,14H2,1-2H3,(H,21,25)(H,22,26)/p+1/t18-/m1/s1