2-[4-(4-carboxyphenyl)phenoxy]ethanoyl-tris(phenylmethyl)azanium

Systemtic Name: 2-[4-(4-carboxyphenyl)phenoxy]ethanoyl-tris(phenylmethyl)azanium Openeye Name: tribenzyl-[2-[4-(4-carboxyphenyl)phenoxy]acetyl]ammonium CAS Name: [2-[4-(4-carboxyphenyl)phenoxy]-1-oxoethyl]-tris(phenylmethyl)ammonium IUPAC Name: tribenzyl-[2-[4-(4-carboxyphenyl)phenoxy]acetyl]azanium Traditional Name: tribenzyl-[2-[4-(4-carboxyphenyl)phenoxy]acetyl]ammonium Formula: C36H32NO4+ MolecularWeight: 542.64358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+](CC2=CC=CC=C2)(CC3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[N+](CC2=CC=CC=C2)(CC3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C36H31NO4/c38-35(27-41-34-22-20-32(21-23-34)31-16-18-33(19-17-31)36(39)40)37(24-28-10-4-1-5-11-28,25-29-12-6-2-7-13-29)26-30-14-8-3-9-15-30/h1-23H,24-27H2/p+1