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

Systemtic Name: 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-butoxybenzoate Openeye Name: 3-(2-methyl-4-oxo-quinazolin-3-yl)propyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid 3-(2-methyl-4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(2-methyl-4-oxoquinazolin-3-yl)propyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid 3-(4-keto-2-methyl-quinazolin-3-yl)propyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCCCN2C(=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCCCN2C(=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C23H26N2O4/c1-3-4-15-28-19-12-10-18(11-13-19)23(27)29-16-7-14-25-17(2)24-21-9-6-5-8-20(21)22(25)26/h5-6,8-13H,3-4,7,14-16H2,1-2H3