(2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: (2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: (2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: (2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: (2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: (2S)-3-[4-[2-(2H-carbazol-9-ium-9-yl)ethoxy]phenyl]-2-ethoxy-propionic acid Formula: C25H26NO4+ MolecularWeight: 404.47824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC[N+]2=C3C=CC=CC3=C4C2=CCC=C4)C(=O)O

Isomeric SMILES

CCO[C@@H](CC1=CC=C(C=C1)OCC[N+]2=C3C=CC=CC3=C4C2=CCC=C4)C(=O)O

InChI

InChI=1S/C25H25NO4/c1-2-29-24(25(27)28)17-18-11-13-19(14-12-18)30-16-15-26-22-9-5-3-7-20(22)21-8-4-6-10-23(21)26/h3-5,7-14,24H,2,6,15-17H2,1H3/p+1/t24-/m0/s1