(2S)-3-cyclohexyl-2-(4-oxidanylidenequinazolin-3-yl)propanoic acid

Systemtic Name: (2S)-3-cyclohexyl-2-(4-oxidanylidenequinazolin-3-yl)propanoic acid Openeye Name: (2S)-3-cyclohexyl-2-(4-oxoquinazolin-3-yl)propanoic acid CAS Name: (2S)-3-cyclohexyl-2-(4-oxo-3-quinazolinyl)propanoic acid IUPAC Name: (2S)-3-cyclohexyl-2-(4-oxoquinazolin-3-yl)propanoic acid Traditional Name: (2S)-3-cyclohexyl-2-(4-ketoquinazolin-3-yl)propionic acid Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)O)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)O)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H20N2O3/c20-16-13-8-4-5-9-14(13)18-11-19(16)15(17(21)22)10-12-6-2-1-3-7-12/h4-5,8-9,11-12,15H,1-3,6-7,10H2,(H,21,22)/t15-/m0/s1