methyl 1-(4-bromanylbutyl)-3-[(4-methoxyphenyl)methyl]-2,4-bis(oxidanylidene)quinazoline-5-carboxylate

Systemtic Name: methyl 1-(4-bromanylbutyl)-3-[(4-methoxyphenyl)methyl]-2,4-bis(oxidanylidene)quinazoline-5-carboxylate Openeye Name: methyl 1-(4-bromobutyl)-3-[(4-methoxyphenyl)methyl]-2,4-dioxo-quinazoline-5-carboxylate CAS Name: 1-(4-bromobutyl)-3-[(4-methoxyphenyl)methyl]-2,4-dioxo-5-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromobutyl)-3-[(4-methoxyphenyl)methyl]-2,4-dioxoquinazoline-5-carboxylate Traditional Name: 1-(4-bromobutyl)-2,4-diketo-3-p-anisyl-quinazoline-5-carboxylic acid methyl ester Formula: C22H23BrN2O5 MolecularWeight: 475.33242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=C(C=CC=C3N(C2=O)CCCCBr)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=C(C=CC=C3N(C2=O)CCCCBr)C(=O)OC

InChI

InChI=1S/C22H23BrN2O5/c1-29-16-10-8-15(9-11-16)14-25-20(26)19-17(21(27)30-2)6-5-7-18(19)24(22(25)28)13-4-3-12-23/h5-11H,3-4,12-14H2,1-2H3