2-[4-[(2S)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[(2S)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[(2S)-2-hydroxy-3-(2-naphthyloxy)propyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(2S)-2-hydroxy-3-(2-naphthalenyloxy)propyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[(2S)-2-hydroxy-3-naphthalen-2-yloxypropyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[(2S)-2-hydroxy-3-(2-naphthoxy)propyl]piperazin-1-ium-1-yl]acetamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C[NH+]1CCN(CC1)CC(COC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

C=CCNC(=O)C[NH+]1CCN(CC1)C[C@@H](COC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C22H29N3O3/c1-2-9-23-22(27)16-25-12-10-24(11-13-25)15-20(26)17-28-21-8-7-18-5-3-4-6-19(18)14-21/h2-8,14,20,26H,1,9-13,15-17H2,(H,23,27)/p+1/t20-/m0/s1