2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 3-butoxybenzoate

Systemtic Name: 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 3-butoxybenzoate Openeye Name: 2-(2-methyl-4-oxo-quinazolin-3-yl)ethyl 3-butoxybenzoate CAS Name: 3-butoxybenzoic acid 2-(2-methyl-4-oxo-3-quinazolinyl)ethyl ester IUPAC Name: 2-(2-methyl-4-oxoquinazolin-3-yl)ethyl 3-butoxybenzoate Traditional Name: 3-butoxybenzoic acid 2-(4-keto-2-methyl-quinazolin-3-yl)ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C22H24N2O4/c1-3-4-13-27-18-9-7-8-17(15-18)22(26)28-14-12-24-16(2)23-20-11-6-5-10-19(20)21(24)25/h5-11,15H,3-4,12-14H2,1-2H3