[(1S)-2-oxidanylidenecyclohexyl] 3-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propanoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propanoate Openeye Name: [(1S)-2-oxocyclohexyl] 3-[4-oxo-3-(p-tolyl)quinazolin-2-yl]propanoate CAS Name: 3-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]propanoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]propanoate Traditional Name: 3-[4-keto-3-(p-tolyl)quinazolin-2-yl]propionic acid [(1S)-2-ketocyclohexyl] ester Formula: C24H24N2O4 MolecularWeight: 404.45836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)OC4CCCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)O[C@H]4CCCCC4=O

InChI

InChI=1S/C24H24N2O4/c1-16-10-12-17(13-11-16)26-22(25-19-7-3-2-6-18(19)24(26)29)14-15-23(28)30-21-9-5-4-8-20(21)27/h2-3,6-7,10-13,21H,4-5,8-9,14-15H2,1H3/t21-/m0/s1