4-[4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)oxy]phenoxy]-3-oxidanylidene-2-propan-2-yloxy-pentanenitrile

Systemtic Name: 4-[4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)oxy]phenoxy]-3-oxidanylidene-2-propan-2-yloxy-pentanenitrile Openeye Name: 4-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)oxy]phenoxy]-2-isopropoxy-3-oxo-pentanenitrile CAS Name: 4-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)oxy]phenoxy]-3-oxo-2-propan-2-yloxypentanenitrile IUPAC Name: 4-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)oxy]phenoxy]-3-oxo-2-propan-2-yloxypentanenitrile Traditional Name: 4-[4-[(6-chloro-4-keto-1H-quinazolin-2-yl)oxy]phenoxy]-2-isopropoxy-3-keto-valeronitrile Formula: C22H20ClN3O5 MolecularWeight: 441.8643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C#N)C(=O)C(C)OC1=CC=C(C=C1)OC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CC(C)OC(C#N)C(=O)C(C)OC1=CC=C(C=C1)OC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C22H20ClN3O5/c1-12(2)29-19(11-24)20(27)13(3)30-15-5-7-16(8-6-15)31-22-25-18-9-4-14(23)10-17(18)21(28)26-22/h4-10,12-13,19H,1-3H3,(H,25,26,28)