benzylazanium; 2-methyl-3-sulfinato-propanoate
Molecular Formula:
C
18
H
26
N
2
O
4
S
InChI:
InChI=1/2C7H9N.C4H8O4S/c2*8-6-7-4-2-1-3-5-7;1-3(4(5)6)2-9(7)8/h2*1-5H,6,8H2;3H,2H2,1H3,(H,5,6)(H,7,8)/f2C7H10N.C4H6O4S/h2*8H;/q2*+1;-2
InChIKey:
InChIKey=LCRWWJZWMCMYCN-VBGYETESCT
SMILES:
CC(CS(=O)[O-])C(=O)[O-].C1=CC=C(C=C1)C[NH3+].C1=CC=C(C=C1)C[NH3+]
Names:
benzylazanium; 2-methyl-3-sulfinato-propanoate
Registries:
PubChem CID 2828756
PubChem ID 3293024