4-[[6-[bis(2-methylpropyl)amino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-[bis(2-methylpropyl)amino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[6-(diisobutylamino)-3-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[6-[bis(2-methylpropyl)amino]-3-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-[bis(2-methylpropyl)amino]pyridin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[6-(diisobutylamino)-3-pyridyl]amino]-4-keto-butyric acid Formula: C17H27N3O3 MolecularWeight: 321.41458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC=C(C=C1)NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC=C(C=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C17H27N3O3/c1-12(2)10-20(11-13(3)4)15-6-5-14(9-18-15)19-16(21)7-8-17(22)23/h5-6,9,12-13H,7-8,10-11H2,1-4H3,(H,19,21)(H,22,23)