[2,6-ditert-butyl-4-[[6-(hydroxymethyl)pyridazin-3-yl]amino]phenyl] ethanoate

Systemtic Name: [2,6-ditert-butyl-4-[[6-(hydroxymethyl)pyridazin-3-yl]amino]phenyl] ethanoate Openeye Name: [2,6-ditert-butyl-4-[[6-(hydroxymethyl)pyridazin-3-yl]amino]phenyl] acetate CAS Name: acetic acid [2,6-ditert-butyl-4-[[6-(hydroxymethyl)-3-pyridazinyl]amino]phenyl] ester IUPAC Name: [2,6-ditert-butyl-4-[[6-(hydroxymethyl)pyridazin-3-yl]amino]phenyl] acetate Traditional Name: acetic acid [2,6-ditert-butyl-4-[(6-methylolpyridazin-3-yl)amino]phenyl] ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)NC2=NN=C(C=C2)CO)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)NC2=NN=C(C=C2)CO)C(C)(C)C

InChI

InChI=1S/C21H29N3O3/c1-13(26)27-19-16(20(2,3)4)10-15(11-17(19)21(5,6)7)22-18-9-8-14(12-25)23-24-18/h8-11,25H,12H2,1-7H3,(H,22,24)