4-[[6-[3-(diethylamino)propylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-[3-(diethylamino)propylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[6-[3-(diethylamino)propylamino]-3-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[6-[3-(diethylamino)propylamino]-3-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-[3-(diethylamino)propylamino]pyridin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[6-[3-(diethylamino)propylamino]-3-pyridyl]amino]-4-keto-butyric acid Formula: C16H26N4O3 MolecularWeight: 322.40264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=NC=C(C=C1)NC(=O)CCC(=O)O

Isomeric SMILES

CCN(CC)CCCNC1=NC=C(C=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H26N4O3/c1-3-20(4-2)11-5-10-17-14-7-6-13(12-18-14)19-15(21)8-9-16(22)23/h6-7,12H,3-5,8-11H2,1-2H3,(H,17,18)(H,19,21)(H,22,23)