(4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-butoxy-3-chloranyl-5-methoxy-benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-butoxy-3-chloranyl-5-methoxy-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-butoxy-3-chloro-5-methoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-methoxybenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-butoxy-3-chloro-5-methoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-methoxy-benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2)OC

InChI

InChI=1S/C21H21ClN2O5/c1-3-4-9-28-19-15(22)10-13(11-17(19)27-2)21(26)29-12-18-23-16-8-6-5-7-14(16)20(25)24-18/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,23,24,25)