4-methylbenzenesulfonate; N-[(E)-2-(3-phenethylbenzooxazol-2-yl)ethenyl]aniline
Molecular Formula:
C
30
H
28
N
2
O
4
S
InChI:
InChI=1/C23H20N2O.C7H8O3S/c1-3-9-19(10-4-1)16-18-25-21-13-7-8-14-22(21)26-23(25)15-17-24-20-11-5-2-6-12-20;1-6-2-4-7(5-3-6)11(8,9)10/h1-15,17H,16,18H2;2-5H,1H3,(H,8,9,10)/fC23H21N2O.C7H7O3S/h24H;/q+1;-1
InChIKey:
InChIKey=XGBFQMCAIJUVOK-JBZSXPLVCF
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)CC[N+]2=C(OC3=CC=CC=C32)C=CNC4=CC=CC=C4
Names:
4-methylbenzenesulfonate; N-[(E)-2-(3-phenethylbenzooxazol-2-yl)ethenyl]aniline
Registries:
PubChem CID 5717111
PubChem ID 3290394