3-amino-4-[3-(1-oxa-4-azoniacyclohex-4-yl)propylamino]benzoate
Molecular Formula:
C
14
H
21
N
3
O
3
InChI:
InChI=1/C14H21N3O3/c15-12-10-11(14(18)19)2-3-13(12)16-4-1-5-17-6-8-20-9-7-17/h2-3,10,16H,1,4-9,15H2,(H,18,19)/f/h17H
InChIKey:
InChIKey=VRHZWWOENWNDPZ-HCKMINDGCL
SMILES:
C1COCC[NH+]1CCCNC2=C(C=C(C=C2)C(=O)[O-])N
Names:
3-amino-4-[3-(1-oxa-4-azoniacyclohex-4-yl)propylamino]benzoate
Registries:
PubChem CID 4117489
PubChem ID 6045456