[2,6-ditert-butyl-4-[[5-(hydroxymethyl)pyrazin-2-yl]amino]phenyl] ethanoate

Systemtic Name: [2,6-ditert-butyl-4-[[5-(hydroxymethyl)pyrazin-2-yl]amino]phenyl] ethanoate Openeye Name: [2,6-ditert-butyl-4-[[5-(hydroxymethyl)pyrazin-2-yl]amino]phenyl] acetate CAS Name: acetic acid [2,6-ditert-butyl-4-[[5-(hydroxymethyl)-2-pyrazinyl]amino]phenyl] ester IUPAC Name: [2,6-ditert-butyl-4-[[5-(hydroxymethyl)pyrazin-2-yl]amino]phenyl] acetate Traditional Name: acetic acid [2,6-ditert-butyl-4-[(5-methylolpyrazin-2-yl)amino]phenyl] ester Formula: C21H29N3O3 MolecularWeight: 371.47326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)NC2=NC=C(N=C2)CO)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)NC2=NC=C(N=C2)CO)C(C)(C)C

InChI

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