4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-5-yl]phenol

Systemtic Name: 4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-5-yl]phenol Openeye Name: 4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-5-yl]phenol CAS Name: 4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-pyrimidinyl]phenol IUPAC Name: 4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-5-yl]phenol Traditional Name: 4-[2,4-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-5-yl]phenol Formula: C26H22N4O5 MolecularWeight: 470.47668

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3C4=CC=C(C=C4)O)NC5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3C4=CC=C(C=C4)O)NC5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C26H22N4O5/c31-19-5-1-16(2-6-19)20-15-27-26(29-18-4-8-22-24(14-18)35-12-10-33-22)30-25(20)28-17-3-7-21-23(13-17)34-11-9-32-21/h1-8,13-15,31H,9-12H2,(H2,27,28,29,30)