[(1S)-2-oxidanylidenecyclohexyl] 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

InChI

InChI=1S/C20H17NO4/c22-17-8-4-5-9-18(17)24-20(23)14-10-11-16-15(12-14)19(25-21-16)13-6-2-1-3-7-13/h1-3,6-7,10-12,18H,4-5,8-9H2/t18-/m0/s1