4,4-bis(azanyl)-2-[2,4-bis(oxidanyl)phenyl]heptan-3-one

Systemtic Name: 4,4-bis(azanyl)-2-[2,4-bis(oxidanyl)phenyl]heptan-3-one Openeye Name: 4,4-diamino-2-(2,4-dihydroxyphenyl)heptan-3-one CAS Name: 4,4-diamino-2-(2,4-dihydroxyphenyl)-3-heptanone IUPAC Name: 4,4-diamino-2-(2,4-dihydroxyphenyl)heptan-3-one Traditional Name: 4,4-diamino-2-(2,4-dihydroxyphenyl)heptan-3-one Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(C)C1=C(C=C(C=C1)O)O)(N)N

Isomeric SMILES

CCCC(C(=O)C(C)C1=C(C=C(C=C1)O)O)(N)N

InChI

InChI=1S/C13H20N2O3/c1-3-6-13(14,15)12(18)8(2)10-5-4-9(16)7-11(10)17/h4-5,7-8,16-17H,3,6,14-15H2,1-2H3