N-(5-chloranyl-1,3-benzodioxol-4-yl)-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine

Systemtic Name: N-(5-chloranyl-1,3-benzodioxol-4-yl)-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine Openeye Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-(3-morpholinopropoxy)quinazolin-4-amine CAS Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-[3-(4-morpholinyl)propoxy]-4-quinazolinamine IUPAC Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-(3-morpholin-4-ylpropoxy)quinazolin-4-amine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[7-(3-morpholinopropoxy)quinazolin-4-yl]amine Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCOC2=CC3=C(C=C2)C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

C1COCCN1CCCOC2=CC3=C(C=C2)C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C22H23ClN4O4/c23-17-4-5-19-21(31-14-30-19)20(17)26-22-16-3-2-15(12-18(16)24-13-25-22)29-9-1-6-27-7-10-28-11-8-27/h2-5,12-13H,1,6-11,14H2,(H,24,25,26)