4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]-5-(oxan-4-yloxy)-1H-quinazolin-7-one

Systemtic Name: 4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]-5-(oxan-4-yloxy)-1H-quinazolin-7-one Openeye Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-tetrahydropyran-4-yloxy-1H-quinazolin-7-one CAS Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-(4-oxanyloxy)-1H-quinazolin-7-one IUPAC Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-(oxan-4-yloxy)-1H-quinazolin-7-one Traditional Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-tetrahydropyran-4-yloxy-1H-quinazolin-7-one Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=CC(=O)C=C3C2=C(N=CN3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

C1COCCC1OC2=CC(=O)C=C3C2=C(N=CN3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C20H18ClN3O5/c21-13-1-2-15-19(28-10-27-15)18(13)24-20-17-14(22-9-23-20)7-11(25)8-16(17)29-12-3-5-26-6-4-12/h1-2,7-9,12,24H,3-6,10H2,(H,22,23)