4,6-ditert-butyl-2-[(Z)-3-(oxidanylamino)-4-phenoxy-but-2-enylidene]pyrimidin-5-one

Systemtic Name: 4,6-ditert-butyl-2-[(Z)-3-(oxidanylamino)-4-phenoxy-but-2-enylidene]pyrimidin-5-one Openeye Name: 4,6-ditert-butyl-2-[(Z)-3-(hydroxyamino)-4-phenoxy-but-2-enylidene]pyrimidin-5-one CAS Name: 4,6-ditert-butyl-2-[(Z)-3-(hydroxyamino)-4-phenoxybut-2-enylidene]-5-pyrimidinone IUPAC Name: 4,6-ditert-butyl-2-[(Z)-3-(hydroxyamino)-4-phenoxybut-2-enylidene]pyrimidin-5-one Traditional Name: 4,6-ditert-butyl-2-[(Z)-3-(hydroxyamino)-4-phenoxy-but-2-enylidene]pyrimidin-5-one Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC=C(COC2=CC=CC=C2)NO)N=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=NC(=C/C=C(/COC2=CC=CC=C2)\NO)N=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H29N3O3/c1-21(2,3)19-18(26)20(22(4,5)6)24-17(23-19)13-12-15(25-27)14-28-16-10-8-7-9-11-16/h7-13,25,27H,14H2,1-6H3/b15-12-