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

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: [(1S)-2-oxocyclohexyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H18N2O4/c20-13-7-3-4-8-14(13)23-16(21)10-9-15-18-12-6-2-1-5-11(12)17(22)19-15/h1-2,5-6,14H,3-4,7-10H2,(H,18,19,22)/t14-/m0/s1