4-[[6-[2-(diethylazaniumyl)ethylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[6-[2-(diethylazaniumyl)ethylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[6-[2-(diethylammonio)ethylamino]-3-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-[[6-[2-(diethylammonio)ethylamino]-3-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[6-[2-(diethylazaniumyl)ethylamino]pyridin-3-yl]amino]-4-oxobutanoate Traditional Name: 4-[[6-[2-(diethylammonio)ethylamino]-3-pyridyl]amino]-4-keto-butyrate Formula: C15H24N4O3 MolecularWeight: 308.37606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC=C(C=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCNC1=NC=C(C=C1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H24N4O3/c1-3-19(4-2)10-9-16-13-6-5-12(11-17-13)18-14(20)7-8-15(21)22/h5-6,11H,3-4,7-10H2,1-2H3,(H,16,17)(H,18,20)(H,21,22)