Catalog Number:
AG003M5E
Chemical Name:
5-Mono(4-carboxyphenyl)-10,15,20-triphenyl porphine
CAS Number:
95051-10-8
Molecular Formula:
C45H30N4O2
Molecular Weight:
658.7453
MDL Number:
MFCD06227751
IUPAC Name:
4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzoic acid
InChI:
InChI=1S/C45H30N4O2/c50-45(51)32-18-16-31(17-19-32)44-39-26-24-37(48-39)42(29-12-6-2-7-13-29)35-22-20-33(46-35)41(28-10-4-1-5-11-28)34-21-23-36(47-34)43(30-14-8-3-9-15-30)38-25-27-40(44)49-38/h1-27,46,49H,(H,50,51)
InChI Key:
GZTMFXHPFNRUNU-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1ccccc1)/C=C3)\c1ccccc1)/[nH]2)/c1ccccc1
