Molecular Formula:
C25H31NO4
InChI: InChI=1/C21H27N.C4H4O4/c1-2-18-10-6-11-19-12-7-13-20(21(18)19)16-22-15-14-17-8-4-3-5-9-17;5-3(6)1-2-4(7)8/h3-6,8-11,20,22H,2,7,12-16H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC21H28N.C4H3O4/h22H;5H/q+1;-1
InChIKey: InChIKey=WCQHPCLYNKQEQL-FZJCMQHVDW
SMILES: CCC1=CC=CC2=C1C(CCC2)C[NH2+]CCC3=CC=CC=C3.C(=CC(=O)[O-])C(=O)O
Names:
(8-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-phenethyl-azanium; (Z)-4-hydroxy-4-oxo-but-2-enoate
Registries:
PubChem CID 6435686
PubChem ID 11621567
