N-(3H-1,2-benzodioxol-6-ylmethyl)-6-chloranyl-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]quinazolin-4-amine

Systemtic Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-6-chloranyl-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]quinazolin-4-amine Openeye Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-6-chloro-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]quinazolin-4-amine CAS Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-6-chloro-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]-4-quinazolinamine IUPAC Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-6-chloro-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]quinazolin-4-amine Traditional Name: 3H-1,2-benzodioxol-6-ylmethyl-[6-chloro-2-[(2-phenyl-1,3-dioxan-5-yl)oxy]quinazolin-4-yl]amine Formula: C26H22ClN3O5 MolecularWeight: 491.92298

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)OC3=NC4=C(C=C(C=C4)Cl)C(=N3)NCC5=CC6=C(COO6)C=C5

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)OC3=NC4=C(C=C(C=C4)Cl)C(=N3)NCC5=CC6=C(COO6)C=C5

InChI

InChI=1S/C26H22ClN3O5/c27-19-8-9-22-21(11-19)24(28-12-16-6-7-18-13-33-35-23(18)10-16)30-26(29-22)34-20-14-31-25(32-15-20)17-4-2-1-3-5-17/h1-11,20,25H,12-15H2,(H,28,29,30)