butanoate; pyridin-1-ium

Systemtic Name: butanoate; pyridin-1-ium Openeye Name: butanoate; pyridin-1-ium CAS Name: butanoate; pyridin-1-ium IUPAC Name: butanoate; pyridin-1-ium Traditional Name: butyrate; pyridin-1-ium Formula: C9H13NO2 MolecularWeight: 167.20502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].C1=CC=[NH+]C=C1

Isomeric SMILES

CCCC(=O)[O-].C1=CC=[NH+]C=C1

InChI

InChI=1S/C5H5N.C4H8O2/c1-2-4-6-5-3-1;1-2-3-4(5)6/h1-5H;2-3H2,1H3,(H,5,6)