4-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[6-(isopentylamino)-3-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-[[6-(3-methylbutylamino)-3-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-4-oxobutanoate Traditional Name: 4-[[6-(isoamylamino)-3-pyridyl]amino]-4-keto-butyrate Formula: C14H20N3O3- MolecularWeight: 278.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c1-10(2)7-8-15-12-4-3-11(9-16-12)17-13(18)5-6-14(19)20/h3-4,9-10H,5-8H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)/p-1