N'-[(3R)-2-oxidanylidene-1-propyl-3H-indol-3-yl]-N-(2-piperidin-1-ium-1-ylethyl)ethanediamide

Systemtic Name: N'-[(3R)-2-oxidanylidene-1-propyl-3H-indol-3-yl]-N-(2-piperidin-1-ium-1-ylethyl)ethanediamide Openeye Name: N'-[(3R)-2-oxo-1-propyl-indolin-3-yl]-N-(2-piperidin-1-ium-1-ylethyl)oxamide CAS Name: N'-[(3R)-2-oxo-1-propyl-3H-indol-3-yl]-N-[2-(1-piperidin-1-iumyl)ethyl]oxamide IUPAC Name: N'-[(3R)-2-oxo-1-propyl-3H-indol-3-yl]-N-(2-piperidin-1-ium-1-ylethyl)oxamide Traditional Name: N'-[(3R)-2-keto-1-propyl-indolin-3-yl]-N-(2-piperidin-1-ium-1-ylethyl)oxamide Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(C1=O)NC(=O)C(=O)NCC[NH+]3CCCCC3

Isomeric SMILES

CCCN1C2=CC=CC=C2[C@H](C1=O)NC(=O)C(=O)NCC[NH+]3CCCCC3

InChI

InChI=1S/C20H28N4O3/c1-2-11-24-16-9-5-4-8-15(16)17(20(24)27)22-19(26)18(25)21-10-14-23-12-6-3-7-13-23/h4-5,8-9,17H,2-3,6-7,10-14H2,1H3,(H,21,25)(H,22,26)/p+1/t17-/m1/s1