4-[[5-[3-(dimethylazaniumyl)propylamino]pyridin-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[5-[3-(dimethylazaniumyl)propylamino]pyridin-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[5-[3-(dimethylammonio)propylamino]-2-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-[[5-[3-(dimethylammonio)propylamino]-2-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[5-[3-(dimethylazaniumyl)propylamino]pyridin-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[5-[3-(dimethylammonio)propylamino]-2-pyridyl]amino]-4-keto-butyrate Formula: C14H22N4O3 MolecularWeight: 294.34948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=CN=C(C=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNC1=CN=C(C=C1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C14H22N4O3/c1-18(2)9-3-8-15-11-4-5-12(16-10-11)17-13(19)6-7-14(20)21/h4-5,10,15H,3,6-9H2,1-2H3,(H,20,21)(H,16,17,19)