(Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(pyridin-3-ylmethylidene)azanium

Systemtic Name: (Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(pyridin-3-ylmethylidene)azanium Openeye Name: (Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(3-pyridylmethylene)ammonium CAS Name: (Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(3-pyridinylmethylidene)ammonium IUPAC Name: (Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(pyridin-3-ylmethylidene)azanium Traditional Name: (Z)-4-[2-(carboxymethyloxy)phenyl]butoxy-phenyl-(3-pyridylmethylene)ammonium Formula: C24H25N2O4+ MolecularWeight: 405.4663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+](=CC2=CN=CC=C2)OCCCCC3=CC=CC=C3OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/[N+](=C/C2=CN=CC=C2)/OCCCCC3=CC=CC=C3OCC(=O)O

InChI

InChI=1S/C24H24N2O4/c27-24(28)19-29-23-14-5-4-10-21(23)11-6-7-16-30-26(22-12-2-1-3-13-22)18-20-9-8-15-25-17-20/h1-5,8-10,12-15,17-18H,6-7,11,16,19H2/p+1