3-[(2S)-2-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-2-yl]-N-(2-piperidin-1-ium-1-ylethyl)propanamide

Systemtic Name: 3-[(2S)-2-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-2-yl]-N-(2-piperidin-1-ium-1-ylethyl)propanamide Openeye Name: 3-[(2S)-2-(1-naphthylmethyl)-5-oxo-pyrrolidin-2-yl]-N-(2-piperidin-1-ium-1-ylethyl)propanamide CAS Name: 3-[(2S)-2-(1-naphthalenylmethyl)-5-oxo-2-pyrrolidinyl]-N-[2-(1-piperidin-1-iumyl)ethyl]propanamide IUPAC Name: 3-[(2S)-2-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-2-yl]-N-(2-piperidin-1-ium-1-ylethyl)propanamide Traditional Name: 3-[(2S)-5-keto-2-(1-naphthylmethyl)pyrrolidin-2-yl]-N-(2-piperidin-1-ium-1-ylethyl)propionamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)CCC2(CCC(=O)N2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)CC[C@@]2(CCC(=O)N2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H33N3O2/c29-23(26-15-18-28-16-4-1-5-17-28)11-13-25(14-12-24(30)27-25)19-21-9-6-8-20-7-2-3-10-22(20)21/h2-3,6-10H,1,4-5,11-19H2,(H,26,29)(H,27,30)/p+1/t25-/m1/s1