(E)-3-[3-(carboxymethyloxy)phenyl]propoxy-cyclohexyl-(phenylmethylidene)azanium

Systemtic Name: (E)-3-[3-(carboxymethyloxy)phenyl]propoxy-cyclohexyl-(phenylmethylidene)azanium Openeye Name: (E)-benzylidene-[3-[3-(carboxymethyloxy)phenyl]propoxy]-cyclohexyl-ammonium CAS Name: (E)-3-[3-(carboxymethyloxy)phenyl]propoxy-cyclohexyl-(phenylmethylene)ammonium IUPAC Name: (E)-benzylidene-[3-[3-(carboxymethyloxy)phenyl]propoxy]-cyclohexylazanium Traditional Name: (E)-benzal-[3-[3-(carboxymethyloxy)phenyl]propoxy]-cyclohexyl-ammonium Formula: C24H30NO4+ MolecularWeight: 396.4993

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[N+](=CC2=CC=CC=C2)OCCCC3=CC(=CC=C3)OCC(=O)O

Isomeric SMILES

C1CCC(CC1)/[N+](=C\C2=CC=CC=C2)/OCCCC3=CC(=CC=C3)OCC(=O)O

InChI

InChI=1S/C24H29NO4/c26-24(27)19-28-23-15-7-11-20(17-23)12-8-16-29-25(22-13-5-2-6-14-22)18-21-9-3-1-4-10-21/h1,3-4,7,9-11,15,17-18,22H,2,5-6,8,12-14,16,19H2/p+1/b25-18+