furan-2-ylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(2S)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]azanium

Systemtic Name: furan-2-ylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]-[(2S)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]azanium Openeye Name: 2-furylmethyl-[(2S)-2-hydroxy-3-(2-naphthyloxy)propyl]-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: 2-furanylmethyl-[(2S)-2-hydroxy-3-(2-naphthalenyloxy)propyl]-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: furan-2-ylmethyl-[(2S)-2-hydroxy-3-naphthalen-2-yloxypropyl]-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: 2-furfuryl-[(2S)-2-hydroxy-3-(2-naphthoxy)propyl]-[4-(methylcarbamoyl)benzyl]ammonium Formula: C27H29N2O4+ MolecularWeight: 445.53016

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C[NH+](CC2=CC=CO2)CC(COC3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)C[NH+](CC2=CC=CO2)C[C@@H](COC3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C27H28N2O4/c1-28-27(31)22-10-8-20(9-11-22)16-29(18-26-7-4-14-32-26)17-24(30)19-33-25-13-12-21-5-2-3-6-23(21)15-25/h2-15,24,30H,16-19H2,1H3,(H,28,31)/p+1/t24-/m0/s1